SCHEMBL29610459

SCHEMBL29610459

Cc1ccc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1-c1cc(C#CC2(NC(=O)OC(C)(C)C)CC2)nc(N2CCOCC2)c1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 19/20 0.77
BRAF P15056 6/20 0.70
PDGFRB P09619 1/20 0.64
ARAF P10398 1/20 0.64
DDR1 Q08345 1/20 0.64
DDR2 Q16832 1/20 0.64

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
SCHEMBL24312210 1.00 RAF1 (0.77) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL24312199 0.90 RAF1 (0.83) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL29610445 0.90 RAF1 (0.83) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL29611219 0.89 RAF1 (0.80) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL24312257 0.89 RAF1 (0.80) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL24312212 0.87 RAF1 (1.00) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL29610521 0.87 RAF1 (1.00) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL24318085 0.87 RAF1 (0.82) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL24312332 0.87 RAF1 (0.82) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL24312435 0.87 RAF1 (0.82) RAF1BRAFPDGFRBARAFDDR1

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-2022081469-A1 INHIBITORS OF RAF KINASES KINNATE BIOPHARMA INC. (US) 2022-04-21 WO disclosed