SCHEMBL1739055

SCHEMBL1739055

Cc1cccc(Cn2c(C)c(C)c3ccnc(Cc4ccccc4)c32)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
FABP4 P15090 1/20 0.45
MAPT P10636 2/20 0.42
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 3/20 0.39
CYP11B1 P15538 2/20 0.39
CYP11B2 P19099 2/20 0.39
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
AVPR1A P37288 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
Hydrochloric Acid SCHEMBL1736469 0.99 TP53 (0.48) TP53MEN1KMT2ANPSR1FABP4
SCHEMBL1738753 0.90 FABP4 (0.51) TP53MEN1KMT2ANPSR1FABP4
Hydrochloric Acid SCHEMBL1736955 0.89 FABP4 (0.50) TP53MEN1KMT2ANPSR1FABP4
SCHEMBL1739039 0.88 FABP4 (0.44) TP53MEN1KMT2ANPSR1FABP4
SCHEMBL1738211 0.88 MAPT (0.47) MEN1KMT2AFABP4MAPTPOLB
SCHEMBL1738562 0.88 MEN1 (0.47) TP53MEN1KMT2ANPSR1FABP4
Hydrochloric Acid SCHEMBL1736892 0.87 MAPT (0.46) TP53MEN1KMT2AFABP4MAPT
Hydrochloric Acid SCHEMBL1735600 0.87 FABP4 (0.43) TP53MEN1KMT2ANPSR1FABP4
Hydrochloric Acid SCHEMBL1738015 0.87 MEN1 (0.46) TP53MEN1KMT2ANPSR1FABP4
SCHEMBL1737552 0.84 FABP4 (0.46) TP53MEN1KMT2ANPSR1FABP4

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