SCHEMBL30236334

SCHEMBL30236334

CNc1cc2ncc(-c3cc(NC(=O)c4ccnc(C(C)(C)C)c4)cnc3C)cc2cn1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 19/20 0.55
▸ BRAF P15056 17/20 0.55
▸ NPC1 O15118 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL29272063 1.00 RAF1 (0.55) RAF1BRAFNPC1LMNARAB9A
SCHEMBL30236886 0.94 RAF1 (0.58) RAF1BRAF
SCHEMBL29272307 0.94 RAF1 (0.58) RAF1BRAF
SCHEMBL29272313 0.93 RAF1 (0.58) RAF1BRAF
SCHEMBL30236612 0.93 RAF1 (0.58) RAF1BRAF
SCHEMBL29272340 0.92 RAF1 (0.58) RAF1BRAF
SCHEMBL29272227 0.91 RAF1 (0.60) RAF1BRAF
SCHEMBL30236732 0.91 RAF1 (0.60) RAF1BRAF
SCHEMBL30236475 0.86 RAF1 (0.57) RAF1BRAF
SCHEMBL29272198 0.86 RAF1 (0.57) 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 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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