SCHEMBL19698929

SCHEMBL19698929

CC(C)c1ncc(C(=O)NCC(=O)O)cc1F

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 13/20 0.43
▸ VEGFA P15692 2/20 0.43
▸ FLT1 P17948 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ EGLN3 Q9H6Z9 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ SLC22A6 Q4U2R8 1/20 0.39
▸ SLC22A8 Q8TCC7 1/20 0.39
▸ PTPRC P08575 2/20 0.38
▸ CTSL P07711 1/20 0.38
▸ PTPN13 Q12923 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HPGDS O60760 1/20 0.38
▸ FTO Q9C0B1 1/20 0.38
▸ USP5 P45974 1/20 0.37

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
SCHEMBL21783356 0.88 ATM (0.40) EGLN1VEGFAFLT1ATMEGLN3
SCHEMBL19698958 0.86 GCG (0.43) KDM4EALDH1A1HPGD
SCHEMBL19705733 0.81 EGLN1 (0.43) EGLN1VEGFAFLT1ATMEGLN3
SCHEMBL25138292 0.81 HDAC6 (0.50) —
SCHEMBL19698930 0.79 GPBAR1 (0.40) ATMKDM4EHPGDS
SCHEMBL19725183 0.79 EGLN1 (0.41) EGLN1VEGFAFLT1ATMEGLN3
SCHEMBL19698928 0.79 HCAR2 (0.43) KDM4EALDH1A1
SCHEMBL19738292 0.78 EGLN1 (0.40) EGLN1VEGFAFLT1ATMEGLN3
SCHEMBL19117337 0.74 MAPK14 (0.39) KDM4EALDH1A1HPGDS
SCHEMBL19105598 0.74 HPGDS (0.41) SMN1; SMN2HPGDS

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739065-B2 FXR (NR1H4) modulating compounds GILEAD SCIENCES, INC. (US) 2023-08-29 — — US disclosed
US-11739065-B2 FXR (NR1H4) modulating compounds GILEAD SCIENCES, INC. (US) 2023-08-29 — — US disclosed
US-20220204460-A1 FXR (NR1H4) MODULATING COMPOUNDS PHENEX PHARMACEUTICALS AG (DE) 2022-06-30 — — US disclosed
EP-3587412-B1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES INC (US) 2022-05-25 — — EP disclosed
US-10981881-B2 FXR (NR1H4) modulating compounds GILEAD SCIENCES, INC. (US) 2021-04-20 — — US disclosed
US-20200369632-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2020-11-26 — — US disclosed
US-20200361920-A1 ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2020-11-19 — — US disclosed
US-10774054-B2 FXR (NR1H4) modulating compounds GILEAD SCIENCES, INC. (US) 2020-09-15 — — US disclosed
US-20200071282-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2020-03-05 — — US disclosed
US-20190308962-A1 FXR (NR1H4) Modulating Compounds GILEAD SCIENCES, INC. (US) 2019-10-10 — — US disclosed
US-10421730-B2 FXR (NR1H4) modulating compounds GILEAD SCIENCES, INC. (US) 2019-09-24 — — US disclosed
EP-3257847-B1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES INC (US) 2019-08-21 — — EP disclosed
WO-2017218330-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2017-12-21 — — WO disclosed
EP-3257847-A1 FXR (NR1H4) MODULATING COMPOUNDS Gilead Sciences, Inc. (US) 2017-12-20 — — EP disclosed
US-20170355685-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2017-12-14 — — US disclosed
US-20170355685-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2017-12-14 — — 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-20190308962-A1 FXR (NR1H4) Modulating Compounds NR1H4, NR1H2, NR1H3 EGLN1 4520/4885VEGFA 4691/4885FLT1 3553/4885
US-10981881-B2 FXR (NR1H4) modulating compounds NR1H4, NR1H2, NR1H3 EGLN1 4450/4885VEGFA 4586/4885FLT1 3477/4885
US-11739065-B2 FXR (NR1H4) modulating compounds NR1H4, NR1H2, NR1H3 EGLN1 4450/4885VEGFA 4586/4885FLT1 3477/4885
US-10421730-B2 FXR (NR1H4) modulating compounds NR1H4, NR1H2, NR1H3 EGLN1 4450/4885VEGFA 4586/4885FLT1 3477/4885
US-20170355685-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 EGLN1 4450/4885VEGFA 4586/4885FLT1 3477/4885
US-20200071282-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 EGLN1 4450/4885VEGFA 4586/4885FLT1 3477/4885
US-20200369632-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 EGLN1 4450/4885VEGFA 4586/4885FLT1 3477/4885
US-20200361920-A1 ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF SLC10A1, NR1H4, SLC10A2 EGLN1 3272/4885VEGFA 4396/4885FLT1 3339/4885
US-20220204460-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 EGLN1 4450/4885VEGFA 4586/4885FLT1 3477/4885
US-10774054-B2 FXR (NR1H4) modulating compounds NR1H4, NR1H2, NR1H3 EGLN1 4450/4885VEGFA 4586/4885FLT1 3477/4885

“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.

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