SCHEMBL2636633

SCHEMBL2636633

Cc1ccc(C2CCN(C(=O)OC(C)(C)C)C2)nc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.54
KDM5A P29375 1/20 0.52
GPR119 Q8TDV5 2/20 0.51
HPGDS O60760 1/20 0.51
TP53 P04637 2/20 0.49
TRPV3 Q8NET8 1/20 0.49
LMNA P02545 2/20 0.48
PDE4B Q07343 1/20 0.47
KMT2A Q03164 1/20 0.47
USP30 Q70CQ3 1/20 0.47
CCNK O75909 1/20 0.46
CDK12 Q9NYV4 1/20 0.46
MAPT P10636 1/20 0.46
NPBWR1 P48145 1/20 0.46
MCHR1 Q99705 1/20 0.46

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
SCHEMBL27393885 1.00 HSD11B1 (0.54) HSD11B1KDM5AGPR119HPGDSTP53
SCHEMBL14851551 0.91 KDM4E (0.46) HSD11B1KDM5AGPR119HPGDSTP53
SCHEMBL30294196 0.88 MEN1 (0.52) HPGDSTP53TRPV3LMNAPDE4B
SCHEMBL19404832 0.88 TRPV3 (0.52) GPR119HPGDSTRPV3PDE4BUSP30
SCHEMBL18741911 0.88 MEN1 (0.52) HPGDSTP53TRPV3LMNAPDE4B
SCHEMBL18115645 0.82 GPR119 (0.59) HSD11B1KDM5AGPR119HPGDSUSP30
SCHEMBL30373604 0.82 GPR119 (0.43) GPR119HPGDSKMT2AUSP30NPBWR1
SCHEMBL12321142 0.82 PDE4B (0.60) GPR119TP53LMNAPDE4BKMT2A
SCHEMBL18352270 0.81 TRPC6 (0.53) HPGDSTRPV3PDE4BMAPT
SCHEMBL23073921 0.81 KDM5A (0.50) KDM5AGPR119HPGDSTRPV3PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9163012-B2 Carbamate and urea inhibitors of 11β-hydroxysteroid dehydrogenase 1 VITAE PHARMACEUTICALS, INC. (US) 2015-10-20 US disclosed
US-9163012-B2 Carbamate and urea inhibitors of 11β-hydroxysteroid dehydrogenase 1 VITAE PHARMACEUTICALS, INC. (US) 2015-10-20 US disclosed
US-9163012-B2 Carbamate and urea inhibitors of 11β-hydroxysteroid dehydrogenase 1 VITAE PHARMACEUTICALS, INC. (US) 2015-10-20 US disclosed
EP-2438043-A1 CARBAMATE AND UREA INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE 1 Vitae Pharmaceuticals, Inc. (US) 2012-04-11 EP disclosed
US-20110053943-A1 CARBAMATE AND UREA INHIBITORS OF 11ß-HYDROXYSTEROID DEHYDROGENASE 1 VITAE PHARMACEUTICALS, INC. 2011-03-03 US disclosed
US-20110053943-A1 CARBAMATE AND UREA INHIBITORS OF 11ß-HYDROXYSTEROID DEHYDROGENASE 1 VITAE PHARMACEUTICALS, INC. 2011-03-03 US disclosed
US-20110053943-A1 CARBAMATE AND UREA INHIBITORS OF 11ß-HYDROXYSTEROID DEHYDROGENASE 1 VITAE PHARMACEUTICALS, INC. 2011-03-03 US disclosed
WO-2010141424-A1 CARBAMATE AND UREA INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE 1 VITAE PHARMACEUTICALS, INC. (US) 2010-12-09 WO disclosed
WO-2010141424-A1 CARBAMATE AND UREA INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE 1 VITAE PHARMACEUTICALS, INC. (US) 2010-12-09 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 (1 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-20110053943-A1 CARBAMATE AND UREA INHIBITORS OF 11ß-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD11B2, HSD3B1 HSD11B1 1/4885KDM5A 738/4885GPR119 1509/4885

“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.