SCHEMBL1739563

SCHEMBL1739563

COc1ccc(Cn2c(C)c(C)c3ccnc(CCc4ccccc4)c32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43
DYRK1A Q13627 1/20 0.42
MAPT P10636 5/20 0.41
ALDH1A1 P00352 5/20 0.41
HTT P42858 3/20 0.41
HPGD P15428 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
KDM4E B2RXH2 4/20 0.41
ALOX15 P16050 1/20 0.41
LMNA P02545 2/20 0.40
P2RX4 Q99571 1/20 0.40
CNR2 P34972 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ENPP2 Q13822 1/20 0.39
ABCB1 P08183 1/20 0.39
RAB9A P51151 1/20 0.39

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 SCHEMBL1737070 0.99 PTGDR2 (0.42) FABP4PTGDR2DYRK1AMAPTALDH1A1
SCHEMBL1737696 0.91 FABP4 (0.50) FABP4PTGDR2DYRK1AMAPTALDH1A1
SCHEMBL1737102 0.90 LTA4H (0.44) FABP4PTGDR2DYRK1AMAPTALDH1A1
Hydrochloric Acid SCHEMBL1735464 0.90 FABP4 (0.49) FABP4PTGDR2DYRK1AMAPTALDH1A1
Hydrochloric Acid SCHEMBL1736508 0.89 LTA4H (0.43) FABP4PTGDR2DYRK1AMAPTALDH1A1
SCHEMBL1737545 0.89 FABP4 (0.46) FABP4PTGDR2DYRK1AMAPTALDH1A1
Hydrochloric Acid SCHEMBL1737023 0.87 FABP4 (0.45) FABP4PTGDR2DYRK1AMAPTALDH1A1
SCHEMBL1739133 0.87 FABP4 (0.45) FABP4PTGDR2DYRK1AMAPTALDH1A1
SCHEMBL1737979 0.86 FABP4 (0.44) FABP4MAPTALDH1A1HPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL1736484 0.86 FABP4 (0.44) FABP4PTGDR2DYRK1AMAPTALDH1A1

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