SCHEMBL1737209

SCHEMBL1737209

CC(=O)c1cc2c(C)c(C)n(Cc3cccc(F)c3)c2c(N2CCc3ccccc3C2)n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 7/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
FABP3 P05413 1/20 0.37
FABP4 P15090 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
THRB P10828 1/20 0.36
PLA2G2A P14555 1/20 0.35

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 SCHEMBL1736928 0.99 ENPP2 (0.37) ENPP2NPC1RAB9AFABP3FABP4
SCHEMBL1735623 0.93 FABP3 (0.41) ENPP2NPC1RAB9AFABP3FABP4
SCHEMBL1736324 0.92 PLA2G2A (0.38) ENPP2NPC1RAB9AFABP3FABP4
SCHEMBL1739451 0.90 L3MBTL1 (0.38) ENPP2NPC1RAB9AMEN1KMT2A
SCHEMBL1737529 0.90 TP53 (0.38) ENPP2NPC1RAB9AFABP3FABP4
Hydrochloric Acid SCHEMBL1736923 0.89 TP53 (0.37) ENPP2NPC1RAB9AFABP3FABP4
Hydrochloric Acid SCHEMBL1738183 0.89 L3MBTL1 (0.38) ENPP2NPC1RAB9AMEN1KMT2A
SCHEMBL1738725 0.89 MAPT (0.38) RAB9ASMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL1736282 0.88 LMNA (0.44) MEN1KMT2ASMN1; SMN2LMNAALDH1A1
SCHEMBL1735946 0.88 MAPT (0.36) ENPP2NPC1RAB9AFABP3FABP4

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 4 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-B1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2011-11-16 EP disclosed
US-20110263306-A1 COMPUTER SYSTEM AND PROGRAM NAMCO BANDAI GAMES INC. (JP) 2011-10-27 US disclosed