SCHEMBL27700490

SCHEMBL27700490

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)N(C)c1cc(-c2ccc(NN3CCOCC3)cc2)ncn1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 17/20 0.57
BRAF P15056 17/20 0.57
LCK P06239 2/20 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
SCHEMBL374138 0.86 RAF1 (0.70) RAF1BRAFLCK
SCHEMBL374338 0.82 LCK (0.68) RAF1BRAFLCK
SCHEMBL374676 0.81 LCK (0.61) RAF1BRAFLCK
SCHEMBL374367 0.80 LCK (0.62) RAF1BRAFLCK
SCHEMBL374728 0.80 LCK (0.65) RAF1BRAFLCK
SCHEMBL374503 0.80 LCK (0.67) RAF1BRAFLCK
SCHEMBL374525 0.79 LCK (0.61) RAF1BRAFLCK
SCHEMBL374523 0.79 LCK (0.63) RAF1BRAFLCK
SCHEMBL374492 0.79 LCK (0.70) RAF1BRAFLCK
SCHEMBL374344 0.78 BRAF (0.56) RAF1BRAFLCK

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
CN-101035769-A Pyrimidine urea derivatives as kinase inhibitors NOVARTIS AG (CH) 2007-09-12 CN claimed