SCHEMBL29272397

SCHEMBL29272397

CNc1cc2ncc(-c3cc(NC(=O)c4ccnc(C(C)(C)F)c4)c(F)cc3C)cc2cn1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 20/20 0.49
▸ BRAF P15056 15/20 0.49
▸ ARAF P10398 1/20 0.49
▸ KRAS P01116 4/20 0.49
▸ KDR P35968 4/20 0.49
▸ MAP2K2 P36507 2/20 0.49
▸ MAP2K1 Q02750 2/20 0.49

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
SCHEMBL30237169 0.92 RAF1 (0.53) RAF1BRAFARAFKRASKDR
SCHEMBL29272102 0.92 RAF1 (0.53) RAF1BRAFARAFKRASKDR
SCHEMBL29272256 0.88 RAF1 (0.57) RAF1BRAFKDR
SCHEMBL30236582 0.88 RAF1 (0.57) RAF1BRAFKDR
SCHEMBL29272163 0.86 KDR (0.43) RAF1BRAFARAFKRASKDR
SCHEMBL30236886 0.85 RAF1 (0.58) RAF1BRAF
SCHEMBL29272307 0.85 RAF1 (0.58) RAF1BRAF
SCHEMBL29272261 0.84 RAF1 (0.47) RAF1BRAFARAFKRASKDR
SCHEMBL30236650 0.84 RAF1 (0.47) RAF1BRAFARAFKRASKDR
SCHEMBL30236859 0.83 RAF1 (0.58) RAF1BRAFKDR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4399210-A1 6-AZA-QUINOLINE DERIVATIVES AND RELATED USES Black Diamond Therapeutics, Inc. (US) 2024-07-17 — — EP disclosed
CN-118159537-A 6-Aza-quinoline derivatives and related uses 黑钻治疗公司 2024-06-07 — — CN disclosed
WO-2023039505-A1 6-AZA-QUINOLINE DERIVATIVES AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2023-03-16 — — WO disclosed
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