SCHEMBL12518252

SCHEMBL12518252

COc1c(CNc2cc(NC(=O)c3ccc(CN4CCNCC4)c(C(F)(F)F)c3)ccc2C)cnc2c1ccn2COCC[Si](C)(C)C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDR1 Q08345 1/20 0.63
▸ KIT P10721 2/20 0.51
▸ CSF1R P07333 1/20 0.51
▸ MAPK14 Q16539 4/20 0.49
▸ MAP3K7 O43318 3/20 0.49
▸ CSK P41240 3/20 0.49
▸ MAP4K2 Q12851 3/20 0.49
▸ MAP3K20 Q9NYL2 3/20 0.49
▸ EPHA2 P29317 2/20 0.49
▸ RAD52 P43351 1/20 0.49
▸ ABL1 P00519 3/20 0.46
▸ MAP4K4 O95819 1/20 0.46
▸ RAF1 P04049 1/20 0.46
▸ LYN P07948 1/20 0.46
▸ SRC P12931 1/20 0.46
▸ EPHB2 P29323 1/20 0.46
▸ ABL2 P42684 1/20 0.46
▸ EPHB4 P54760 1/20 0.46
▸ EGFR P00533 1/20 0.45
▸ BRAF P15056 1/20 0.45

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
SCHEMBL2276365 0.94 DDR1 (0.70) DDR1MAPK14MAP3K7CSKMAP4K2
SCHEMBL22457387 0.85 DDR1 (0.58) DDR1MAPK14MAP3K7CSKMAP4K2
SCHEMBL2280488 0.83 DDR1 (0.58) DDR1RAD52
SCHEMBL12518257 0.83 DDR1 (0.88) DDR1KITCSF1RMAPK14MAP3K7
SCHEMBL2276363 0.81 DDR1 (0.53) DDR1MAPK14MAP3K7CSKMAP4K2
SCHEMBL2284120 0.77 DDR1 (1.00) DDR1MAPK14MAP3K7CSKMAP4K2
SCHEMBL17208616 0.75 DDR1 (0.85) DDR1MAPK14MAP3K7CSKMAP4K2
SCHEMBL17515255 0.75 DDR1 (0.95) DDR1MAPK14MAP3K7CSKMAP4K2
SCHEMBL2280492 0.74 DDR1 (0.46) DDR1MAPK14MAP3K7CSKMAP4K2
SCHEMBL26882862 0.72 DDR1 (0.78) DDR1MAPK14MAP3K7CSKMAP4K2

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-2011090738-A2 TYPE II RAF KINASE INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2011-07-28 — — WO disclosed
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