SCHEMBL14197567

SCHEMBL14197567

COc1cnc2[nH]cc(Cc3ccc(NCC4C=CC(C(F)(F)F)=CC4)nc3)c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 3/20 0.64
▸ CYP3A4 P08684 11/20 0.50
▸ CYP2C19 P33261 5/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ KIT P10721 2/20 0.46
▸ LCK P06239 1/20 0.46
▸ PGR P06401 1/20 0.46
▸ CHRM2 P08172 1/20 0.46
▸ HTR1A P08908 1/20 0.46
▸ ADRA2A P08913 1/20 0.46
▸ PDGFRB P09619 1/20 0.46
▸ ADORA3 P0DMS8 1/20 0.46
▸ CHRM1 P11229 1/20 0.46
▸ PDGFRA P16234 1/20 0.46
▸ FLT1 P17948 1/20 0.46
▸ DRD1 P21728 1/20 0.46
▸ TBXA2R P21731 1/20 0.46
▸ SLC6A2 P23975 1/20 0.46
▸ ADORA1 P30542 1/20 0.46
▸ SLC6A4 P31645 1/20 0.46

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
SCHEMBL14198421 0.88 CSF1R (0.56) CSF1RCYP3A4CYP2C19CYP1A2KIT
SCHEMBL14196178 0.88 CSF1R (0.49) CSF1RCYP3A4CYP2C19CYP1A2KIT
SCHEMBL14197568 0.87 CYP2C19 (0.48) CSF1RCYP3A4CYP2C19CYP1A2KIT
SCHEMBL14196173 0.87 CSF1R (0.61) CSF1RCYP3A4CYP2C19CYP1A2KIT
SCHEMBL14197870 0.87 CSF1R (0.49) CSF1RCYP3A4CYP2C19CYP1A2KIT
SCHEMBL14196170 0.86 CSF1R (0.48) CSF1RCYP3A4CYP2C19CYP1A2KIT
SCHEMBL14198419 0.84 CSF1R (0.61) CSF1RCYP3A4CYP2C19KITLCK
SCHEMBL14193692 0.81 CSF1R (0.44) CSF1RCYP3A4CYP1A2KITKDR
SCHEMBL2180534 0.78 CSF1R (1.00) CSF1RCYP3A4CYP2C19CYP1A2KIT
SCHEMBL1885108 0.77 CSF1R (0.81) CSF1RCYP3A4CYP2C19CYP1A2KIT

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 1 patent. 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
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