SCHEMBL1737577

SCHEMBL1737577

CCn1c(C)c(C)c2ccnc(-c3ccccc3)c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 1/20 0.42
NQO2 P16083 1/20 0.39
BCHE P06276 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 1/20 0.38
HTR2B P41595 1/20 0.37
HTR5A P47898 1/20 0.37
TDO2 P48775 1/20 0.37
FABP4 P15090 3/20 0.37
FABP5 Q01469 1/20 0.37
MCL1 Q07820 3/20 0.36
CCNA2 P20248 2/20 0.36
CDK2 P24941 2/20 0.36
NPY5R Q15761 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
ADORA1 P30542 1/20 0.35
ACSS2 Q9NR19 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
Hydrochloric Acid SCHEMBL1737346 0.99 RPS6KA5 (0.41) RPS6KA5NQO2BCHEKDM4EHSD17B10
SCHEMBL1736374 0.89 ADORA2B (0.39) RPS6KA5NQO2BCHEKDM4EHTR2B
SCHEMBL1737146 0.88 MCL1 (0.38) RPS6KA5BCHEKDM4EHSD17B10MCL1
Hydrochloric Acid SCHEMBL1735622 0.87 ADORA2B (0.38) RPS6KA5NQO2BCHEKDM4EHTR2B
Hydrochloric Acid SCHEMBL1738501 0.87 MCL1 (0.38) RPS6KA5BCHEKDM4EHSD17B10MCL1
SCHEMBL1737107 0.86 FABP4 (0.51) KDM4EHSD17B10FABP4MCL1ALDH1A1
SCHEMBL1737433 0.86 LMNA (0.40) KDM4EHSD17B10TDO2CCNA2CDK2
SCHEMBL1738538 0.86 KMT2A (0.40) BCHEKDM4EMCL1CCNA2CDK2
SCHEMBL1737061 0.86 ALDH1A1 (0.43) NQO2BCHEKDM4EHSD17B10HTR2B
SCHEMBL1738910 0.85 PDE4B (0.46) KDM4EADORA2A

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 5 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 disclosed
EP-1784404-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-05-16 EP disclosed
WO-2006025716-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO disclosed