SCHEMBL20008250

SCHEMBL20008250

C=C(Nc1ccc(C)c(C(/C=C\C)=N/NC)c1)c1ccnc(CC)c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
POLB P06746 1/20 0.34
RAF1 P04049 3/20 0.33
BRAF P15056 3/20 0.33
PRKCI P41743 1/20 0.33

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
SCHEMBL20009217 0.67 RAF1 (0.39) RAF1BRAF
SCHEMBL20009306 0.66 RAF1 (0.36) RAF1BRAF
SCHEMBL20008527 0.65 RAF1 (0.36) RAF1BRAF
SCHEMBL20009716 0.64 RAF1 (0.41) RAF1BRAF
SCHEMBL24713128 0.63 CYP1A2 (0.36) CYP1A2POLBRAF1BRAFPRKCI
SCHEMBL20008367 0.63 RAF1 (0.41) RAF1BRAF
SCHEMBL21766418 0.61 PRKCI (0.52) CYP1A2POLBBRAFPRKCI
SCHEMBL15880501 0.60 PRKCI (0.62) CYP1A2POLBPRKCI
SCHEMBL20009609 0.60 BTK (0.32) BRAF
SCHEMBL9444923 0.60 CYP1A2 (0.61) CYP1A2POLBPRKCI

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