SCHEMBL3620336

SCHEMBL3620336

Nc1nc(CC(=O)N2CCCCC2)cs1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 1/20 0.57
GABRB2 P47870 1/20 0.57
HSD17B10 Q99714 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.52
EGLN1 Q9GZT9 1/20 0.48
F2 P00734 2/20 0.45
F10 P00742 2/20 0.45
HPGD P15428 2/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 2/20 0.43
ATM Q13315 1/20 0.43
NPC1 O15118 1/20 0.42
HSD11B1 P28845 1/20 0.38

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
SCHEMBL3540370 0.89 F2 (0.58) GABRA5GABRB2HSD17B10SMN1; SMN2EGLN1
SCHEMBL19820647 0.87 HSD17B10 (0.47) GABRA5GABRB2HSD17B10SMN1; SMN2F2
SCHEMBL3621586 0.87 GABRA5 (0.55) GABRA5GABRB2HSD17B10SMN1; SMN2EGLN1
Hydrochloric Acid SCHEMBL19814023 0.86 HSD17B10 (0.46) GABRA5GABRB2HSD17B10SMN1; SMN2F2
Hydrochloric Acid SCHEMBL20640317 0.86 HSD17B10 (0.46) GABRA5GABRB2HSD17B10SMN1; SMN2F2
SCHEMBL2111372 0.85 SMN1; SMN2 (0.58) GABRA5GABRB2HSD17B10SMN1; SMN2LMNA
SCHEMBL14159379 0.85 GABRA5 (0.54) GABRA5GABRB2HSD17B10SMN1; SMN2EGLN1
SCHEMBL20640293 0.84 KDM4E (0.51) GABRA5GABRB2HSD17B10F2F10
SCHEMBL20649160 0.84 GABRA5 (0.53) GABRA5GABRB2HSD17B10SMN1; SMN2EGLN1
Hydrochloric Acid SCHEMBL20640363 0.83 GABRA5 (0.51) GABRA5GABRB2HSD17B10SMN1; SMN2EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100113435-A1 INHIBITORS OF 11-BETA-HYDROXY STERIOD DEHYDROGENASE TYPE 1 BIOVITRUM AB 2010-05-06 US disclosed
US-7618961-B2 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2009-11-17 US disclosed
CN-1249039-C Inhibitors of 11 beta-hydroxysteroid dehydrogenase type I BIOVITRUM AB (SE) 2006-04-05 CN disclosed
US-20040224996-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2004-11-11 US disclosed
CN-1438997-A Inhibitors of 11-beta-hydroxy steroid dehydrogenase type I BIOVITRUM AB (SE) 2003-08-27 CN disclosed
EP-1283831-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-02-19 EP disclosed
WO-2001090090-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2001-11-29 WO 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 (2 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-20040224996-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD17B1, HSD11B2 GABRA5 2105/4885GABRB2 1661/4885HSD17B10 21/4885
US-20100113435-A1 INHIBITORS OF 11-BETA-HYDROXY STERIOD DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD3B1 GABRA5 2377/4885GABRB2 1435/4885HSD17B10 23/4885

“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.