SCHEMBL5593544

SCHEMBL5593544

CCNC(=O)c1cc(-c2cc(NC(=O)c3cc(F)cc(N4CCOCC4)c3)ccc2C)no1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 7/20 0.59
BRAF P15056 7/20 0.59
MAPK14 Q16539 13/20 0.56

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
SCHEMBL4551704 0.94 MAPK14 (0.57) RAF1BRAFMAPK14
SCHEMBL14473141 0.93 RAF1 (0.56) RAF1BRAFMAPK14
SCHEMBL4565118 0.91 RAF1 (0.56) RAF1BRAFMAPK14
SCHEMBL4552283 0.91 RAF1 (0.56) RAF1BRAFMAPK14
SCHEMBL5593026 0.91 RAF1 (0.61) RAF1BRAFMAPK14
SCHEMBL4541475 0.91 RAF1 (0.56) RAF1BRAFMAPK14
SCHEMBL4551205 0.90 RAF1 (0.62) RAF1BRAFMAPK14
SCHEMBL4410023 0.90 RAF1 (0.55) RAF1BRAFMAPK14
SCHEMBL4409101 0.90 RAF1 (0.55) RAF1BRAFMAPK14
SCHEMBL4566569 0.90 RAF1 (0.55) RAF1BRAFMAPK14

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-2007075896-A2 HETEROCYCLIC CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-07-05 WO disclosed