SCHEMBL1737781

SCHEMBL1737781

COc1ccc2c(c1)C(C)N(c1nccc3c(C)c(C)n(Cc4cccc(F)c4)c13)CC2

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.39
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
GAA P10253 1/20 0.34
PARP1 P09874 1/20 0.34
CES2 O00748 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PLA2G2A P14555 1/20 0.34
ADAM17 P78536 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
ENPP2 Q13822 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 SCHEMBL1735581 0.99 MAPT (0.38) MAPTGRIN1GRIN2BGAAPARP1
SCHEMBL1736043 0.92 HTR6 (0.35) MAPTKDM4EALDH1A1HSD17B10PLA2G2A
Hydrochloric Acid SCHEMBL1736873 0.91 HTR6 (0.34) MAPTKDM4EALDH1A1HSD17B10PLA2G2A
SCHEMBL1737665 0.89 HTR6 (0.35) MAPTALDH1A1HSD17B10PLA2G2AENPP2
SCHEMBL1738012 0.88 FABP4 (0.35) ALDH1A1HSD17B10PLA2G2AENPP2
Hydrochloric Acid SCHEMBL1737491 0.88 HTR6 (0.34) MAPTPLA2G2AENPP2
Hydrochloric Acid SCHEMBL1736728 0.88 FABP4 (0.35) ALDH1A1HSD17B10PLA2G2AENPP2
SCHEMBL1737566 0.88 HTR6 (0.35) MAPTKDM4EALDH1A1HSD17B10PLA2G2A
Hydrochloric Acid SCHEMBL1737036 0.87 HTR6 (0.35) MAPTKDM4EALDH1A1HSD17B10PLA2G2A
SCHEMBL1737168 0.86 CCNT1 (0.37) MAPTKDM4EALDH1A1

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 5 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 disclosed
EP-1784404-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-05-16 EP disclosed
WO-2006025716-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO disclosed