SCHEMBL29272480

SCHEMBL29272480

CNc1cc2ncc(-c3cc(NC(=O)c4cc([C@@H](O)C(C)(F)F)ccn4)cnc3C)cc2cn1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 20/20 0.45
▸ BRAF P15056 20/20 0.45
▸ ARAF P10398 1/20 0.41

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
SCHEMBL29272062 1.00 RAF1 (0.45) RAF1BRAFARAF
SCHEMBL30236687 1.00 RAF1 (0.45) RAF1BRAFARAF
SCHEMBL29272065 1.00 RAF1 (0.45) RAF1BRAFARAF
SCHEMBL30237250 1.00 RAF1 (0.45) RAF1BRAFARAF
SCHEMBL30236745 1.00 RAF1 (0.45) RAF1BRAFARAF
SCHEMBL29272368 0.94 RAF1 (0.44) RAF1BRAFARAF
SCHEMBL30236178 0.94 RAF1 (0.44) RAF1BRAFARAF
SCHEMBL30236247 0.94 RAF1 (0.44) RAF1BRAFARAF
SCHEMBL30236305 0.94 RAF1 (0.44) RAF1BRAFARAF
SCHEMBL29272208 0.89 RAF1 (0.45) RAF1BRAFARAF

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-118159537-A 6-Aza-quinoline derivatives and related uses 黑钻治疗公司 2024-06-07 — — CN disclosed
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