SCHEMBL1739552

SCHEMBL1739552

Cc1c(C)n(Cc2ccc(F)cc2)c2c(Cc3ccccc3)nccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.45
MCL1 Q07820 1/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 2/20 0.41
REN P00797 1/20 0.40
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
NR2F2 P24468 1/20 0.38
HTT P42858 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.38
DYRK1A Q13627 1/20 0.37
POLB P06746 1/20 0.37
THRB P10828 1/20 0.37

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 SCHEMBL1736627 0.99 FABP4 (0.44) FABP4MCL1LMNATP53REN
SCHEMBL1738753 0.93 FABP4 (0.51) FABP4MCL1LMNATP53MEN1
Hydrochloric Acid SCHEMBL1736955 0.91 FABP4 (0.50) FABP4MCL1LMNATP53MEN1
SCHEMBL1738562 0.90 MEN1 (0.47) FABP4MCL1LMNATP53MEN1
SCHEMBL1737979 0.89 FABP4 (0.44) FABP4MCL1LMNATP53MEN1
Hydrochloric Acid SCHEMBL1738015 0.89 MEN1 (0.46) FABP4MCL1LMNATP53MEN1
SCHEMBL1737552 0.89 FABP4 (0.46) FABP4LMNATP53MEN1KMT2A
SCHEMBL1739039 0.88 FABP4 (0.44) FABP4TP53RENMEN1KMT2A
Hydrochloric Acid SCHEMBL1736685 0.88 FABP4 (0.44) FABP4MCL1LMNATP53MEN1
Hydrochloric Acid SCHEMBL1736842 0.88 FABP4 (0.45) FABP4LMNATP53MEN1KMT2A

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