SCHEMBL4893115

SCHEMBL4893115

C[C@]12CCC3c4ccc(O)cc4CCC3C1[C@H](CCC(=O)O)CC2=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STS P08842 2/20 0.69
▸ HSD17B1 P14061 6/20 0.57
▸ ESR1 P03372 4/20 0.57
▸ ESR2 Q92731 3/20 0.57
▸ LMNA P02545 2/20 0.57
▸ MAPT P10636 2/20 0.57
▸ HIF1A Q16665 2/20 0.57
▸ SHBG P04278 2/20 0.57
▸ AKR1B10 O60218 1/20 0.57
▸ CYP1A2 P05177 1/20 0.57
▸ PGR P06401 1/20 0.57
▸ SERPINA6 P08185 1/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ AR P10275 1/20 0.57
▸ CYP19A1 P11511 1/20 0.57
▸ AKR1B1 P15121 1/20 0.57
▸ NFKB1 P19838 1/20 0.57
▸ SLC6A4 P31645 1/20 0.57
▸ OPRM1 P35372 1/20 0.57
▸ SNCA P37840 1/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4893106 1.00 STS (0.69) STSHSD17B1ESR1ESR2LMNA
SCHEMBL217081 0.94 STS (0.62) STSHSD17B1ESR1ESR2LMNA
SCHEMBL218464 0.94 STS (0.62) STSHSD17B1ESR1ESR2LMNA
SCHEMBL217082 0.94 STS (0.62) STSHSD17B1ESR1ESR2LMNA
SCHEMBL18652154 0.94 STS (0.62) STSHSD17B1ESR1ESR2LMNA
SCHEMBL218463 0.94 STS (0.62) STSHSD17B1ESR1ESR2LMNA
SCHEMBL2738481 0.94 STS (0.62) STSHSD17B1ESR1ESR2LMNA
SCHEMBL5025212 0.92 STS (0.60) STSHSD17B1ESR1ESR2LMNA
SCHEMBL5025218 0.92 STS (0.60) STSHSD17B1ESR1ESR2LMNA
SCHEMBL22089284 0.92 STS (0.59) STSHSD17B1ESR1ESR2LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3634975-B1 17-OXIMES OF 15.BETA.-[3-PROPANAMIDO]-SUBSTITUTED ESTRA-1,3,5(10)-TRIEN-17-ONES FOR USE IN INHIBITION OF 17.BETA.-HYDROXYSTEROID DEHYDROGENASES ORGANON R&D FINLAND LTD (FI) 2024-02-28 — — EP disclosed
US-20220127303-A1 THERAPEUTICALLY ACTIVE STEROIDAL DERIVATIVES FORENDO PHARMA LTD (FI) 2022-04-28 — — US disclosed
US-11254703-B2 Therapeutically active steroidal derivatives FORENDO PHARMA LTD (FI) 2022-02-22 — — US disclosed
US-20200317718-A1 THERAPEUTICALLY ACTIVE STEROIDAL DERIVATIVES FORENDO PHARMA LTD (FI) 2020-10-08 — — US disclosed
WO-2020115371-A1 ESTRA-1,3,5(10)-TRIENE COMPOUNDS CONDENSED IN POSITION 16(17) WITH A PYRAZOLE RING AS INHIBITORS OF 17-HSD1 FORENDO PHARMA LTD (FI) 2020-06-11 — — WO disclosed
US-10626140-B2 Prodrugs of 17β-HSD1-inhibitors FORENDO PHARMA LTD (FI) 2020-04-21 — — US disclosed
EP-3013845-B1 THERAPEUTICALLY ACTIVE ESTRATRIENTHIAZOLE DERIVATIVES AS INHIBITORS OF 17B-HYDROXYSTEROID DEHYDROGENASE, TYPE 1 FORENDO PHARMA LTD (FI) 2020-03-18 — — EP disclosed
US-10413557-B2 Prodrugs of 17.BETA.-HSD1-inhibitors FORENDO PHARMA LTD. (FI) 2019-09-17 — — US disclosed
US-10377791-B2 Therapeutically active estratrienthiazole derivatives as inhibitors of 17 B-hydroxysteroid dehydrogenase, type 1 FORENDO PHARMA LTD. (FI) 2019-08-13 — — US disclosed
US-9850272-B2 Therapeutically active estratrienthiazole derivatives as inhibitors of 17.beta-hydroxy-steroid dehydrogenase, type 1 FORENDO PHARMA LTD. (FI) 2017-12-26 — — US disclosed
US-20170114090-A1 THERAPEUTICALLY ACTIVE ESTRATRIENTHIAZOLE DERIVATIVES AS HINIBITORS OF 17 B-HYDROXYSTEROID DEHYDROGENASE, TYPE 1 FORENDO PHARMA LTD (FI) 2017-04-27 — — US disclosed
US-20170081356-A1 THERAPEUTICALLY ACTIVE ESTRATRIENTHIAZOLE DERIVATIVES AS INHIBITORS OF 17.BETA-HYDROXY-STEROID DEHYDROGENASE, TYPE 1 FORENDO PHARMA LTD (FI) 2017-03-23 — — US disclosed
US-20170081356-A1 THERAPEUTICALLY ACTIVE ESTRATRIENTHIAZOLE DERIVATIVES AS INHIBITORS OF 17.BETA-HYDROXY-STEROID DEHYDROGENASE, TYPE 1 FORENDO PHARMA LTD (FI) 2017-03-23 — — US disclosed
US-20170081357-A1 THERAPEUTICALLY ACTIVE 17-NITROGEN SUBSTITUTED ESTRATREINTHIAZOLE DERIVATIVES AS INHIBITORS OF 17.BETA-HYDROXYSTEROID DEHYDROGENASE FORENDO PHARMA LTD (FI) 2017-03-23 — — US disclosed
US-20170081357-A1 THERAPEUTICALLY ACTIVE 17-NITROGEN SUBSTITUTED ESTRATREINTHIAZOLE DERIVATIVES AS INHIBITORS OF 17.BETA-HYDROXYSTEROID DEHYDROGENASE FORENDO PHARMA LTD (FI) 2017-03-23 — — US disclosed
WO-2014207311-A1 THERAPEUTICALLY ACTIVE ESTRATRIENTHIAZOLE DERIVATIVES AS INHIBITORS OF 17.BETA.-HYDROXY-STEROID DEHYDROGENASE, TYPE 1 FORENDO PHARMA LTD (FI) 2014-12-31 — — WO disclosed
WO-2014207309-A1 THERAPEUTICALLY ACTIVE ESTRATRIENTHIAZOLE DERIVATIVES AS INHIBITORS OF 17 B-HYDROXYSTEROID DEHYDROGENASE, TYPE 1 FORENDO PHARMA LTD (FI) 2014-12-31 — — WO disclosed
WO-2014207310-A1 THERAPEUTICALLY ACTIVE 17-NITROGEN SUBSTITUTED ESTRATRIENTHIAZOLE DERIVATIVES AS INHIBITORS OF 17.BETA.-HYDROXYSTEROID DEHYDROGENASE FORENDO PHARMA LTD (FI) 2014-12-31 — — WO disclosed
US-8288367-B2 Treatment or inhibition of a steroid hormone dependent disorder; reducing spermatogenesis or male virility; 17 beta -hydroxysteroid dehydrogenase (17 beta-HSD) inhibitors; compounds such as 3-(benzylamino)-15alpha-(4-morpholin-4-yl-4-oxobutyl)estra-1(10),2,4-trien-17-one SOLVAY PHARMACEUTICALS GMBH (DE) 2012-10-16 — — US disclosed
US-20080255075-A1 SUBSTITUTED ESTRATRIENE DERIVATIVES AS 17BETA HSD INHIBITORS SOLVAY PHARMACEUTICALS GMBH (DE) 2008-10-16 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080255075-A1 SUBSTITUTED ESTRATRIENE DERIVATIVES AS 17BETA HSD INHIBITORS HSD17B11, HSD17B1, HSD17B2 STS 33/4885HSD17B1 2/4885ESR1 113/4885
US-10413557-B2 Prodrugs of 17.BETA.-HSD1-inhibitors HSD17B11, HSD17B1, HSD17B7 STS 53/4885HSD17B1 2/4885ESR1 68/4885
US-20170081357-A1 THERAPEUTICALLY ACTIVE 17-NITROGEN SUBSTITUTED ESTRATREINTHIAZOLE DERIVATIVES AS INHIBITORS OF 17.BETA-HYDROXYSTEROID DEHYDROGENASE HSD17B11, HSD17B1, HSD17B3 STS 26/4885HSD17B1 2/4885ESR1 51/4885
US-20220127303-A1 THERAPEUTICALLY ACTIVE STEROIDAL DERIVATIVES HSD17B11, NR5A1, CYP17A1 STS 39/4885HSD17B1 4/4885ESR1 46/4885
US-10626140-B2 Prodrugs of 17β-HSD1-inhibitors HSD17B11, HSD17B1, CYP17A1 STS 70/4885HSD17B1 2/4885ESR1 35/4885
US-11254703-B2 Therapeutically active steroidal derivatives HSD17B11, NR5A1, CYP17A1 STS 38/4885HSD17B1 4/4885ESR1 42/4885
US-10377791-B2 Therapeutically active estratrienthiazole derivatives as inhibitors of 17 B-hydroxysteroid dehydrogenase, type 1 HSD17B1, HSD17B11, HSD17B3 STS 43/4885HSD17B1 1/4885ESR1 72/4885
US-20200317718-A1 THERAPEUTICALLY ACTIVE STEROIDAL DERIVATIVES HSD17B11, NR5A1, CYP17A1 STS 38/4885HSD17B1 4/4885ESR1 42/4885
US-20170081356-A1 THERAPEUTICALLY ACTIVE ESTRATRIENTHIAZOLE DERIVATIVES AS INHIBITORS OF 17.BETA-HYDROXY-STEROID DEHYDROGENASE, TYPE 1 HSD17B11, HSD17B1, HSD17B3 STS 32/4885HSD17B1 2/4885ESR1 64/4885
US-20170114090-A1 THERAPEUTICALLY ACTIVE ESTRATRIENTHIAZOLE DERIVATIVES AS HINIBITORS OF 17 B-HYDROXYSTEROID DEHYDROGENASE, TYPE 1 HSD17B1, HSD17B11, HSD17B3 STS 39/4885HSD17B1 1/4885ESR1 82/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback