SCHEMBL3943641

SCHEMBL3943641

Nc1ccc2[nH]c(OC(=O)NC3CC3)c(-c3ccccc3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LHCGR P22888 1/20 0.44
FAAH O00519 1/20 0.42
MAPK10 P53779 1/20 0.41
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 1/20 0.40
GSK3B P49841 1/20 0.39
ADK P55263 1/20 0.39
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
MAP2 P11137 2/20 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
SCHEMBL3951020 0.95 FAAH (0.50) LHCGRFAAHMAPK10ALDH1A1RAB9A
SCHEMBL3945148 0.83 MAPT (0.56) LHCGRALDH1A1GSK3BKDM4EMAPT
SCHEMBL3947601 0.83 BRD4 (0.42) ALDH1A1GSK3BADKKDM4EGAA
SCHEMBL4930105 0.81 ALDH1A1 (0.54) ALDH1A1KDM4EGAAMAPTMAP2
SCHEMBL3951863 0.79 ALDH1A1 (0.43) FAAHALDH1A1GSK3BADKKDM4E
SCHEMBL3945036 0.79 MAPT (0.53) LHCGRFAAHMAPK10ALDH1A1RAB9A
SCHEMBL3946744 0.78 LIPE (0.41) ALDH1A1GSK3BADKKDM4EGAA
SCHEMBL3942136 0.78 NPC1 (0.39) ALDH1A1RAB9AGSK3BADKKDM4E
SCHEMBL3951513 0.77 HTR2C (0.39) FAAHALDH1A1GSK3BADKKDM4E
SCHEMBL5187596 0.76 NPC1 (0.41) ALDH1A1RAB9AKDM4EGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1802572-B1 INDOL DERIVATIVES AS INHIBITORS OF SOLUBLE ADENYLYL CYCLASE BAYER SCHERING PHARMA AG (DE) 2009-04-22 EP disclosed
EP-1802572-A1 INDOL DERIVATIVES AS INHIBITORS OF SOLUBLE ADENYLYL CYCLASE Bayer Schering Pharma Aktiengesellschaft (DE) 2007-07-04 EP disclosed
WO-2006032541-A1 INDOL DERIVATIVES AS INHIBITORS OF SOLUBLE ADENYLYL CYCLASE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-03-30 WO disclosed