SCHEMBL1737504

SCHEMBL1737504

COc1ccc(-c2nccc3c(C)c(C)n(Cc4ccccc4)c23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
HTT P42858 5/20 0.48
HPGD P15428 3/20 0.48
NPSR1 Q6W5P4 3/20 0.48
MAPT P10636 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TP53 P04637 1/20 0.48
KDM4E B2RXH2 4/20 0.45
GAA P10253 2/20 0.45
CCNA2 P20248 1/20 0.45
CDK2 P24941 1/20 0.45
FABP4 P15090 1/20 0.44
LMNA P02545 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CNR2 P34972 1/20 0.44
DYRK1A Q13627 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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 SCHEMBL1736943 0.99 ALDH1A1 (0.47) ALDH1A1HTTHPGDNPSR1MAPT
SCHEMBL1738237 0.95 CCNA2 (0.45) ALDH1A1HTTHPGDNPSR1MAPT
Hydrochloric Acid SCHEMBL1736718 0.94 CCNA2 (0.44) ALDH1A1HTTHPGDNPSR1MAPT
SCHEMBL1739797 0.94 ALDH1A1 (0.46) ALDH1A1HTTHPGDNPSR1MAPT
Hydrochloric Acid SCHEMBL1735548 0.93 ALDH1A1 (0.44) ALDH1A1HTTHPGDNPSR1MAPT
SCHEMBL1737422 0.91 LMNA (0.46) ALDH1A1HTTMAPTSMN1; SMN2TP53
SCHEMBL1738897 0.90 USP2 (0.48) ALDH1A1HPGDMAPTTP53LMNA
SCHEMBL1737126 0.90 TP53 (0.47) ALDH1A1HTTMAPTSMN1; SMN2TP53
SCHEMBL1737684 0.90 TP53 (0.47) ALDH1A1HTTMAPTSMN1; SMN2TP53
Hydrochloric Acid SCHEMBL1736621 0.90 LMNA (0.46) ALDH1A1HTTMAPTSMN1; SMN2TP53

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