SCHEMBL1739779

SCHEMBL1739779

COCCn1c(C)c(C)c2ccnc(CCc3ccccc3)c21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
NPC1 O15118 1/20 0.50
NR2F2 P24468 1/20 0.50
RAB9A P51151 1/20 0.50
ALDH1A1 P00352 13/20 0.44
CYP1A2 P05177 12/20 0.44
CYP2C19 P33261 11/20 0.44
CYP3A4 P08684 10/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C9 P11712 9/20 0.43
TSHR P16473 6/20 0.43
CASP1 P29466 6/20 0.42
CASP7 P55210 6/20 0.42
HSD17B10 Q99714 6/20 0.42
CYP2D6 P10635 2/20 0.42
LMNA P02545 1/20 0.42
USP2 O75604 5/20 0.41
HPGD P15428 3/20 0.41
HIF1A Q16665 1/20 0.41

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 SCHEMBL1736472 0.99 MEN1 (0.49) MEN1KMT2ANPC1NR2F2RAB9A
SCHEMBL1737696 0.84 FABP4 (0.50) MEN1KMT2ANPC1NR2F2RAB9A
SCHEMBL1737115 0.84 MEN1 (0.41) MEN1KMT2ANPC1NR2F2RAB9A
Hydrochloric Acid SCHEMBL1735614 0.83 MEN1 (0.43) MEN1KMT2ANPC1NR2F2RAB9A
Hydrochloric Acid SCHEMBL1735464 0.83 FABP4 (0.49) MEN1KMT2ANPC1NR2F2RAB9A
SCHEMBL1737421 0.81 KDM4E (0.38) MEN1KMT2ANPC1NR2F2RAB9A
SCHEMBL1735963 0.81 KDM4E (0.41) MEN1KMT2ANPC1RAB9AALDH1A1
Hydrochloric Acid SCHEMBL1738010 0.81 KDM4E (0.40) MEN1KMT2ANPC1NR2F2RAB9A
SCHEMBL1739563 0.81 FABP4 (0.43) RAB9AALDH1A1LMNAHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL1735619 0.80 KDM4E (0.43) MEN1KMT2ANPC1RAB9AALDH1A1

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