SCHEMBL29427277

SCHEMBL29427277

COc1ccc(CNc2ncc3cc(-c4cc(NC(=O)c5ccnc(C(F)(F)F)c5)ccc4C)c(C)nc3n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 19/20 0.48
▸ BRAF P15056 14/20 0.48
▸ PDGFRB P09619 1/20 0.44
▸ ARAF P10398 1/20 0.44
▸ DDR1 Q08345 1/20 0.44
▸ DDR2 Q16832 1/20 0.44

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
SCHEMBL22612950 1.00 RAF1 (0.48) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL29427274 0.88 RAF1 (0.59) RAF1BRAF
SCHEMBL22612883 0.88 RAF1 (0.59) RAF1BRAF
SCHEMBL22612833 0.86 RAF1 (0.56) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL29427242 0.86 RAF1 (0.56) RAF1BRAFPDGFRBARAFDDR1
SCHEMBL22612725 0.85 RAF1 (0.55) RAF1BRAF
SCHEMBL29427269 0.85 RAF1 (0.55) RAF1BRAF
SCHEMBL22612733 0.84 RAF1 (0.51) RAF1BRAF
SCHEMBL29427268 0.84 RAF1 (0.51) RAF1BRAF
SCHEMBL22625518 0.83 RAF1 (0.50) 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-3962484-A1 INHIBITORS OF RAF KINASES Kinnate Biopharma Inc. (US) 2022-03-09 — — EP disclosed
Send feedback