SCHEMBL12478916

SCHEMBL12478916

COC(=O)C(C)C(Cc1ccccc1)c1nc(Nc2ccc(C3CCNCC3)cc2)ncc1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 14/20 0.56
▸ FLT4 P35916 9/20 0.52
▸ KDR P35968 2/20 0.50

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
SCHEMBL12478142 0.89 PTK2 (0.49) PTK2FLT4KDR
SCHEMBL14576969 0.87 PTK2 (0.48) PTK2FLT4KDR
SCHEMBL14576563 0.81 PTK2 (0.53) PTK2FLT4KDR
SCHEMBL12478967 0.80 PTK2 (0.50) PTK2FLT4KDR
SCHEMBL15514223 0.77 PTK2 (0.54) PTK2FLT4KDR
SCHEMBL15512969 0.76 PTK2 (0.51) PTK2FLT4KDR
SCHEMBL14576493 0.75 PTK2 (0.49) PTK2FLT4KDR
SCHEMBL15524884 0.73 PTK2 (0.43) PTK2FLT4KDR
SCHEMBL15514817 0.73 PTK2 (0.48) PTK2FLT4KDR
SCHEMBL12478260 0.73 PTK2 (0.54) PTK2FLT4KDR

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
EP-2675793-A1 FAK INHIBITORS Cancer Therapeutics Crc Pty Limited (AU) 2013-12-25 — — EP disclosed
WO-2012110773-A1 FAK INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2012-08-23 — — WO disclosed
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