SCHEMBL1738215

SCHEMBL1738215

Cc1c(C)n(CC=Cc2ccccc2)c2c(CCc3ccccc3)nccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 5/20 0.41
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
ADRA2A P08913 2/20 0.36
CHRM1 P11229 2/20 0.36
ADRB3 P13945 2/20 0.36
ADRA2C P18825 2/20 0.36
CHRM3 P20309 2/20 0.36
S1PR1 P21453 2/20 0.36
FPR1 P21462 2/20 0.36
SLC6A2 P23975 2/20 0.36
HRH2 P25021 2/20 0.36
FPR3 P25089 2/20 0.36
HTR2A P28223 2/20 0.36
AGTR1 P30556 2/20 0.36
GPR183 P32249 2/20 0.36
OPRM1 P35372 2/20 0.36
APLNR P35414 2/20 0.36
OPRK1 P41145 2/20 0.36

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
SCHEMBL1738213 1.00 NPSR1 (0.41) NPSR1CHRM2CHRM4CHRM5ADRA2A
Hydrochloric Acid SCHEMBL1736879 0.99 NPSR1 (0.40) NPSR1CHRM2CHRM4CHRM5ADRA2A
Hydrochloric Acid SCHEMBL1737889 0.99 NPSR1 (0.40) NPSR1CHRM2CHRM4CHRM5ADRA2A
SCHEMBL1738218 0.85 KDM4E (0.36) LMNAKDM4EMEN1KMT2AFABP4
Hydrochloric Acid SCHEMBL1738701 0.84 KDM4E (0.38) LMNAKDM4EMEN1KMT2AFABP4
SCHEMBL1737982 0.83 KDM4E (0.37) CHRM1LMNAKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL1737694 0.82 KDM4E (0.39) CHRM1LMNAKDM4EMEN1KMT2A
SCHEMBL1737115 0.82 MEN1 (0.41) TSHRKDM4EMEN1KMT2AFABP4
SCHEMBL1737696 0.82 FABP4 (0.50) NPSR1LMNATSHRKDM4EMEN1
Hydrochloric Acid SCHEMBL1735614 0.81 MEN1 (0.43) KDM4EMEN1KMT2AFABP4NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784404-B1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2011-11-16 EP claimed
US-20110263306-A1 COMPUTER SYSTEM AND PROGRAM NAMCO BANDAI GAMES INC. (JP) 2011-10-27 US claimed
EP-1784404-A4 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2009-09-09 EP claimed
JP-2008511621-A 2008-04-17 JP claimed
EP-1784404-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-05-16 EP claimed
WO-2006025716-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO claimed