SCHEMBL16281029

SCHEMBL16281029

COCCOCCOCCOCCN(C)C1CCN(Cc2ccc(-c3cc4nccc(Oc5ccc(NC(=O)NC6CC6)cc5F)c4s3)nc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MST1R Q04912 19/20 0.55
▸ MET P08581 2/20 0.53
▸ AXL P30530 2/20 0.53
▸ KDR P35968 2/20 0.53
▸ FLT3 P36888 2/20 0.53
▸ NTRK1 P04629 1/20 0.53
▸ KIT P10721 1/20 0.53
▸ NTRK2 Q16620 1/20 0.53
▸ PLK4 O00444 1/20 0.51
▸ MAP4K4 O95819 1/20 0.51
▸ ABL1 P00519 1/20 0.51
▸ LCK P06239 1/20 0.51
▸ FYN P06241 1/20 0.51
▸ LYN P07948 1/20 0.51
▸ HCK P08631 1/20 0.51
▸ PDGFRB P09619 1/20 0.51
▸ BCR P11274 1/20 0.51
▸ SRC P12931 1/20 0.51
▸ ABL2 P42684 1/20 0.51
▸ FRK P42685 1/20 0.51

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
SCHEMBL16176981 0.96 MST1R (0.57) MST1RMETAXLKDRFLT3
SCHEMBL14839477 0.93 MST1R (0.54) MST1RMETAXLKDRFLT3
SCHEMBL14873233 0.92 MST1R (0.53) MST1RMETAXLKDRFLT3
SCHEMBL14873201 0.92 MST1R (0.54) MST1RMETAXLKDRFLT3
SCHEMBL14873211 0.92 MST1R (0.54) MST1RMETAXLKDRFLT3
SCHEMBL2537169 0.92 MST1R (0.56) MST1RMETAXLKDRFLT3
SCHEMBL16176648 0.92 MST1R (0.56) MST1RMETKDR
SCHEMBL12254391 0.91 MST1R (0.56) MST1RMETAXLKDRFLT3
SCHEMBL14873235 0.91 MST1R (0.53) MST1RMETAXLKDRFLT3
SCHEMBL14873194 0.91 MST1R (0.57) MST1RMETAXLKDRFLT3

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
US-8906852-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-12-09 — — US disclosed
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