SCHEMBL20009576

SCHEMBL20009576

C=C(Nc1cnc(C)c(C(=C/C)/C=C(\NC)N2CCCCC2)c1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 19/20 0.40
BRAF P15056 19/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL20009265 0.74 BTK (0.45) RAF1BRAF
SCHEMBL20008497 0.72 BRAF (0.45) RAF1BRAF
SCHEMBL20008132 0.69 RAF1 (0.44) RAF1BRAF
SCHEMBL21091770 0.68 RAF1 (0.56) RAF1BRAF
SCHEMBL20008530 0.66 RAF1 (0.38) RAF1BRAF
SCHEMBL19068928 0.63 RAF1 (0.57) RAF1BRAF
SCHEMBL20008137 0.63 PIK3C3 (0.31)
SCHEMBL20008505 0.63 RAF1 (0.47) RAF1BRAF
SCHEMBL21877180 0.62 KCNQ3 (0.63) RAF1BRAFLMNA
SCHEMBL26815890 0.62 RAF1 (0.65) RAF1BRAF

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-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed