SCHEMBL14196167

SCHEMBL14196167

COc1nc(NCC2C=CC(Cl)=CC2)ccc1Cc1c[nH]c2ncccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 12/20 0.54
▸ CYP2C19 P33261 2/20 0.54
▸ CYP2C9 P11712 6/20 0.44
▸ GPR84 Q9NQS5 1/20 0.42
▸ FGFR1 P11362 1/20 0.40
▸ FGFR4 P22455 1/20 0.40
▸ KIT P10721 2/20 0.40
▸ KDR P35968 2/20 0.40
▸ FLT3 P36888 2/20 0.40
▸ AURKC Q9UQB9 2/20 0.40
▸ CSF1R P07333 1/20 0.39
▸ CYP1A2 P05177 2/20 0.38
▸ MET P08581 1/20 0.37
▸ DRD4 P21917 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ CDC7 O00311 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ PRKACA P17612 1/20 0.35
▸ CDK2 P24941 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
SCHEMBL14194977 0.89 CYP3A4 (0.45) CYP3A4CYP2C19CYP2C9GPR84FGFR1
SCHEMBL14197363 0.88 CYP3A4 (0.54) CYP3A4CYP2C19CYP2C9GPR84FGFR1
SCHEMBL13976950 0.87 GPR84 (0.45) CYP3A4CYP2C19CYP2C9GPR84FGFR1
SCHEMBL14197360 0.81 CSF1R (0.53) CYP3A4CYP2C19GPR84FGFR1FGFR4
SCHEMBL14194089 0.78 CYP3A4 (0.47) CYP3A4CYP2C19CYP2C9GPR84FGFR1
SCHEMBL1267508 0.77 CYP3A4 (0.63) CYP3A4CYP2C19CYP2C9GPR84FGFR1
SCHEMBL14196175 0.76 CSF1R (0.51) CYP3A4CYP2C19CYP2C9GPR84FGFR1
SCHEMBL14198431 0.76 FGFR1 (0.39) CYP3A4CYP2C19GPR84FGFR1FGFR4
SCHEMBL1266525 0.75 GPR84 (0.61) CYP3A4CYP2C19CYP2C9GPR84FGFR1
SCHEMBL14194080 0.75 GPR84 (0.42) CYP3A4CYP2C19GPR84FGFR1FGFR4

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
WO-2008064255-A2 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2008-05-29 — — WO disclosed
WO-2008064265-A2 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2008-05-29 — — WO disclosed
Send feedback