SCHEMBL30236502

SCHEMBL30236502

CNc1cc2ncc(-c3cc(NC(=O)c4cc(C(F)(F)F)ccn4)ccc3C)cc2cn1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 9/20 0.60
▸ KDR P35968 5/20 0.60
▸ MAPK14 Q16539 5/20 0.60
▸ MAPK13 O15264 1/20 0.60
▸ MAPK12 P53778 1/20 0.60
▸ MAPK11 Q15759 1/20 0.60
▸ RAF1 P04049 15/20 0.57
▸ LCK P06239 4/20 0.55
▸ JAK3 P52333 4/20 0.55
▸ TEK Q02763 2/20 0.51

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
SCHEMBL29272241 1.00 BRAF (0.60) BRAFKDRMAPK14MAPK13MAPK12
SCHEMBL29272354 0.94 RAF1 (0.58) BRAFKDRMAPK14MAPK13MAPK12
SCHEMBL30236523 0.94 RAF1 (0.58) BRAFKDRMAPK14MAPK13MAPK12
SCHEMBL30236478 0.94 RAF1 (0.58) BRAFKDRMAPK14MAPK13MAPK12
SCHEMBL29272204 0.94 RAF1 (0.58) BRAFKDRMAPK14MAPK13MAPK12
SCHEMBL29272387 0.90 BRAF (0.58) BRAFKDRMAPK14MAPK13MAPK12
SCHEMBL30237164 0.90 BRAF (0.58) BRAFKDRMAPK14MAPK13MAPK12
SCHEMBL29272112 0.90 BRAF (0.49) BRAFKDRMAPK14MAPK13MAPK12
SCHEMBL29272420 0.90 BRAF (0.49) BRAFKDRMAPK14MAPK13MAPK12
SCHEMBL30236458 0.89 KDR (0.48) BRAFKDRMAPK14MAPK13MAPK12

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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