SCHEMBL29763404

SCHEMBL29763404

CC(C)Nc1nc(N)nc(-c2cccc(C(F)(F)F)n2)n1

nearest known ligand 0.82

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 19/20 0.82
▸ IDH2 P48735 4/20 0.61

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
SCHEMBL15094733 1.00 IDH1 (0.82) IDH1IDH2
SCHEMBL15102690 0.91 IDH1 (0.67) IDH1IDH2
SCHEMBL29561127 0.91 IDH1 (0.67) IDH1IDH2
SCHEMBL16393257 0.90 IDH1 (1.00) IDH1IDH2
SCHEMBL16369807 0.90 IDH1 (0.83) IDH1IDH2
SCHEMBL17960995 0.89 IDH1 (0.84) IDH1IDH2
SCHEMBL17960838 0.89 IDH1 (0.84) IDH1IDH2
SCHEMBL22271233 0.89 IDH1 (0.64) IDH1IDH2
SCHEMBL21573273 0.86 IDH1 (0.85) IDH1IDH2
SCHEMBL22271258 0.86 IDH1 (0.84) IDH1IDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115536635-A Therapeutically active compounds and methods of use thereof 法国施维雅药厂 2022-12-30 — — CN disclosed
CN-115521264-A Therapeutically active compounds and methods of use thereof 法国施维雅药厂 2022-12-27 — — CN disclosed
CN-114933585-A Therapeutically active compounds and methods of use thereof 法国施维雅药厂 2022-08-23 — — CN disclosed
CN-108912066-B Therapeutically active compounds and methods of use thereof 安吉奥斯医药品有限公司 2022-06-24 — — CN disclosed
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