SCHEMBL14693148

SCHEMBL14693148

CC(C)(C)OC(=O)N1CCC(C(=O)Nc2cc(Oc3ccc(NC(=O)Nc4ccc(F)cc4)c(CI)c3)ccn2)CC1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.54
BRAF P15056 13/20 0.54

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
SCHEMBL14693162 0.93 KDR (0.52) KDRBRAF
SCHEMBL12673779 0.89 KDR (0.65) KDRBRAF
SCHEMBL2178375 0.89 KDR (0.59) KDRBRAF
SCHEMBL14693143 0.88 KDR (0.47) KDRBRAF
SCHEMBL14437841 0.85 KDR (0.46) KDRBRAF
SCHEMBL14693158 0.84 KDR (0.43) KDRBRAF
SCHEMBL14392001 0.83 KDR (0.50) KDRBRAF
SCHEMBL4328450 0.83 KDR (0.51) KDRBRAF
SCHEMBL14437328 0.83 PTPN2 (0.46) KDRBRAF
SCHEMBL12673833 0.82 KDR (0.64) KDRBRAF

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-8372981-B2 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-02-12 US disclosed