SCHEMBL14196599

SCHEMBL14196599

FC(F)(F)C1=CCC(CNc2ccc(Cc3c[nH]c4ncc(OCCN5CCOCC5)cc34)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 3/20 0.47
▸ CYP2C19 P33261 4/20 0.41
▸ KIT P10721 3/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ LCK P06239 1/20 0.41
▸ PGR P06401 1/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ PDGFRB P09619 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ PDGFRA P16234 1/20 0.41
▸ FLT1 P17948 1/20 0.41
▸ DRD1 P21728 1/20 0.41
▸ TBXA2R P21731 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ ADORA1 P30542 1/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ ADRA1A P35348 1/20 0.41

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
SCHEMBL1267328 0.83 CSF1R (0.68) CSF1RCYP2C19KITAURKBLCK
SCHEMBL14194083 0.80 CYP3A4 (0.40) CSF1RCYP2C19KITAURKBLCK
SCHEMBL1267483 0.79 CYP3A4 (0.54) CSF1RCYP2C19KITAURKBLCK
SCHEMBL14196170 0.78 CSF1R (0.48) CSF1RCYP2C19KITAURKBLCK
SCHEMBL1267604 0.76 CSF1R (0.71) CSF1RCYP2C19KITAURKBLCK
SCHEMBL14705849 0.76 NTRK1 (0.49) CSF1RKITHTR1ADRD1CYP3A4
SCHEMBL14197571 0.76 NTRK1 (0.45) CSF1RCYP2C19KITDRD1CYP3A4
SCHEMBL20376563 0.74 NTRK1 (0.52) KITHTR1ADRD1CYP3A4NTRK1
SCHEMBL12338615 0.72 CSF1R (0.57) CSF1RCYP2C19KITAURKBLCK
SCHEMBL15316822 0.71 CYP3A4 (0.44) CSF1RCYP2C19KITCYP3A4AURKA

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-2008064265-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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