SCHEMBL8815048

SCHEMBL8815048

Cc1cccc(N)c1Nc1cccn2c(C)c(C)nc12

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 12/20 0.50
CYP2C9 P11712 12/20 0.50
CYP2D6 P10635 9/20 0.50
CYP2C19 P33261 8/20 0.50
CYP1A2 P05177 7/20 0.50
ATP4A P20648 2/20 0.40
ATP4B P51164 2/20 0.40
GAA P10253 2/20 0.38
MAPT P10636 1/20 0.38
LCK P06239 1/20 0.37
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL6379545 0.78 CYP3A4 (0.72) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL5220990 0.77 ATP4A (0.51) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL13176306 0.74 CYP1A2 (0.58) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL6351492 0.72 CYP3A4 (0.81) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL6351485 0.71 CYP3A4 (0.51) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL8184998 0.71 CYP3A4 (0.44) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL6354965 0.71 CYP3A4 (0.54) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL16301844 0.71 RAPGEF4 (0.59) CYP3A4CYP2C9CYP1A2GAAMAPT
Hydrochloric Acid SCHEMBL6355106 0.70 CYP3A4 (0.59) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL8803895 0.69 CYP3A4 (0.83) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773946-A1 IMIDAZOPYRIDINE-AZOLIDINONES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1997-05-21 EP disclosed
WO-1996003405-A1 IMIDAZOPYRIDINE-AZOLIDINONES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1996-02-08 WO disclosed