SCHEMBL5816482

SCHEMBL5816482

Cc1c[nH]c(-c2cc(C(=O)Nc3ccc(C)c(N4Cc5cnc6[nH]ccc6c5N(C)C4=O)c3)cc(C(F)(F)F)c2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 4/20 0.54
▸ TNK2 Q07912 16/20 0.53
▸ MAP4K2 Q12851 16/20 0.53
▸ BMX P51813 5/20 0.53
▸ LCK P06239 1/20 0.53
▸ FES P07332 1/20 0.53
▸ RET P07949 1/20 0.53
▸ PDGFRB P09619 1/20 0.53
▸ KIT P10721 1/20 0.53
▸ FGFR1 P11362 1/20 0.53
▸ SRC P12931 1/20 0.53
▸ PDGFRA P16234 1/20 0.53
▸ FLT1 P17948 1/20 0.53
▸ FGFR3 P22607 1/20 0.53
▸ EPHA3 P29320 1/20 0.53
▸ KDR P35968 1/20 0.53
▸ EPHB4 P54760 1/20 0.53
▸ TEK Q02763 1/20 0.53
▸ KARS1 Q15046 1/20 0.53
▸ NTRK3 Q16288 1/20 0.53

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
SCHEMBL5814944 0.93 MAP4K2 (0.50) ABL1TNK2MAP4K2BMXLCK
SCHEMBL5820599 0.83 MAP4K2 (0.67) ABL1TNK2MAP4K2BMXLCK
SCHEMBL5813589 0.82 TNK2 (0.61) ABL1TNK2MAP4K2BMXLCK
SCHEMBL5815047 0.82 MAP4K2 (0.61) ABL1TNK2MAP4K2BMXLCK
SCHEMBL5820634 0.82 MAP4K2 (0.55) ABL1TNK2MAP4K2BMXLCK
SCHEMBL5812530 0.81 MAP4K2 (0.60) ABL1TNK2MAP4K2BMXLCK
SCHEMBL5818951 0.80 MAP4K2 (0.52) ABL1TNK2MAP4K2BMXLCK
SCHEMBL5820613 0.79 TNK2 (0.57) ABL1TNK2MAP4K2BMXLCK
SCHEMBL3827882 0.78 TNK2 (0.66) ABL1TNK2MAP4K2BMXLCK
SCHEMBL5819608 0.78 MAP4K2 (0.62) ABL1TNK2MAP4K2FESSRC

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-2006124731-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-11-23 — — WO claimed
WO-2006124731-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-11-23 — — WO disclosed
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