SCHEMBL14147160

SCHEMBL14147160

CCN(CC)CCOc1cnc2[nH]cc(C(O)c3ccc(NCc4ccc(C(F)F)cc4)nc3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 3/20 0.42
▸ CYP1A2 P05177 1/20 0.36
▸ BTK Q06187 7/20 0.36
▸ SRC P12931 7/20 0.36
▸ LYN P07948 5/20 0.36
▸ CYP2C19 P33261 3/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ CYP3A4 P08684 3/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ KIT P10721 2/20 0.33
▸ LCK P06239 1/20 0.33
▸ PGR P06401 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ PDGFRB P09619 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ PDGFRA P16234 1/20 0.33
▸ FLT1 P17948 1/20 0.33

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
SCHEMBL12341853 0.91 CSF1R (0.54) CSF1RCYP1A2BTKSRCLYN
SCHEMBL12341433 0.88 CSF1R (0.53) CSF1RCYP1A2CYP2C19BRD4CYP3A4
SCHEMBL12343934 0.78 CSF1R (0.55) CSF1RCYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL12338611 0.77 CSF1R (0.40) CSF1RCYP1A2CYP2C19BRD4KIT
SCHEMBL21304793 0.76 CSF1R (0.59) CSF1RCYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL1267558 0.75 CSF1R (0.75) CSF1RCYP1A2CYP2C19BRD4CYP3A4
SCHEMBL14147163 0.75 KDR (0.44) CSF1RCYP1A2CYP2C19CYP3A4FLT1
SCHEMBL12342106 0.75 CSF1R (0.51) CSF1RCYP2C19BRD4KITLCK
SCHEMBL12341431 0.75 CSF1R (0.49) CSF1RBRD4KITKDRFLT3
SCHEMBL19302326 0.72 CSF1R (0.58) CSF1RCYP1A2CYP2C19CYP3A4CYP2D6

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-2008079909-A1 PYRROLO [2,3-B] PYRIDINES AS KINASE MODULATORS PLEXXIKON, INC. (US) 2008-07-03 — — WO disclosed
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