SCHEMBL1739153

SCHEMBL1739153

Cc1c(C)n(CC2CC2)c2c(CCc3ccccc3)nccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.36
ACHE P22303 1/20 0.36
KDM4E B2RXH2 2/20 0.35
FABP4 P15090 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ADRA1A P35348 1/20 0.35
HRH1 P35367 1/20 0.35
ADRA1B P35368 1/20 0.35
CNR2 P34972 3/20 0.33
PDE5A O76074 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
NOTUM Q6P988 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
CXCR4 P61073 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33

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 SCHEMBL1736935 0.99 KDM4E (0.37) OPRK1ACHEKDM4EFABP4MEN1
SCHEMBL1737228 0.89 MERTK (0.39) OPRK1ACHEFABP4CNR2PDE5A
Hydrochloric Acid SCHEMBL1738042 0.88 MERTK (0.39) OPRK1ACHEFABP4CNR2PDE5A
SCHEMBL1735981 0.87 KDM4E (0.35) ACHEKDM4EFABP4MEN1KMT2A
Hydrochloric Acid SCHEMBL1737769 0.86 KDM4E (0.36) ACHEKDM4EFABP4MEN1KMT2A
SCHEMBL1737696 0.84 FABP4 (0.50) KDM4EFABP4MEN1KMT2ANOTUM
SCHEMBL1737115 0.84 MEN1 (0.41) KDM4EFABP4MEN1KMT2AHPGD
Hydrochloric Acid SCHEMBL1735614 0.83 MEN1 (0.43) KDM4EFABP4MEN1KMT2AHPGD
Hydrochloric Acid SCHEMBL1735464 0.83 FABP4 (0.49) KDM4EFABP4MEN1KMT2ALMNA
SCHEMBL7483012 0.82 CYP1A2 (0.39) OPRK1KDM4EFABP4MEN1KMT2A

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