SCHEMBL17208644

SCHEMBL17208644

CCN1CCN(Cc2ccc(NC(=O)F)cc2C(F)(F)F)CC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 5/20 0.64
▸ KDR P35968 4/20 0.64
▸ MKNK2 Q9HBH9 10/20 0.61
▸ MKNK1 Q9BUB5 8/20 0.61
▸ ABL1 P00519 6/20 0.61
▸ BCR P11274 6/20 0.61
▸ KIT P10721 4/20 0.57
▸ CLK1 P49759 2/20 0.57
▸ PDGFRB P09619 2/20 0.57
▸ PDGFRA P16234 2/20 0.57
▸ FGFR2 P21802 2/20 0.57
▸ FLT3 P36888 2/20 0.57
▸ STK25 O00506 1/20 0.57
▸ CIT O14578 1/20 0.57
▸ MAP2K7 O14733 1/20 0.57
▸ IKBKB O14920 1/20 0.57
▸ AURKA O14965 1/20 0.57
▸ GAK O14976 1/20 0.57
▸ CHUK O15111 1/20 0.57
▸ MUSK O15146 1/20 0.57

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
SCHEMBL27088109 0.90 RET (0.64) RETKDRMKNK2MKNK1ABL1
SCHEMBL14704589 0.90 MKNK2 (0.65) RETKDRMKNK2MKNK1ABL1
SCHEMBL3182950 0.89 RET (0.63) RETKDRMKNK2MKNK1ABL1
SCHEMBL16380144 0.89 RET (0.63) RETKDRMKNK2MKNK1ABL1
SCHEMBL15785403 0.89 MKNK2 (0.65) RETKDRMKNK2MKNK1ABL1
SCHEMBL16587846 0.88 RET (0.68) RETKDRMKNK2MKNK1ABL1
SCHEMBL12516824 0.88 RET (0.62) RETKDRMKNK2MKNK1ABL1
SCHEMBL31053458 0.86 FGFR4 (0.61) RETKDRMKNK2MKNK1ABL1
SCHEMBL14704625 0.85 RET (0.59) RETKDRMKNK2MKNK1ABL1
SCHEMBL16587312 0.85 RET (0.64) RETKDRMKNK2MKNK1ABL1

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
EP-2937345-A2 Type II raf kinase inhibitors Dana-Farber Cancer Institute, Inc. (US) 2015-10-28 — — EP disclosed
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