SCHEMBL29230884

SCHEMBL29230884

Cc1cc(C(NC(=O)C2CC(F)CN2C(=O)Cc2cnn[nH]2)c2ccccc2)cc(F)c1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 16/20 0.36
▸ XIAP P98170 1/20 0.34
▸ ITGA4 P13612 1/20 0.34
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ PSMB9 P28065 1/20 0.33

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
SCHEMBL24665638 1.00 CFD (0.36) CFDXIAPITGA4CNR1CNR2
SCHEMBL30341384 1.00 CFD (0.36) CFDXIAPITGA4CNR1CNR2
SCHEMBL30341231 0.95 CFD (0.35) CFDXIAPCNR1CNR2PSMB9
SCHEMBL24666467 0.95 CFD (0.35) CFDXIAPCNR1CNR2PSMB9
SCHEMBL29231112 0.95 CFD (0.35) CFDXIAPCNR1CNR2PSMB9
SCHEMBL26819303 0.90 TACR1 (0.34) CFDITGA4CNR1CNR2
SCHEMBL24665720 0.88 CFD (0.35) CFDXIAPITGA4PSMB9
SCHEMBL24665655 0.88 CFD (0.35) CFDXIAPCNR1CNR2PSMB9
SCHEMBL29231067 0.88 CFD (0.35) CFDXIAPCNR1CNR2PSMB9
SCHEMBL29231420 0.88 CFD (0.35) CFDXIAPITGA4PSMB9

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
CN-117956985-A Inhibitors of glycogen synthase 1 (GYS 1) and methods of use thereof 梅兹治疗公司 2024-04-30 — — CN disclosed
EP-4308095-A1 INHIBITORS OF GLYCOGEN SYNTHASE 1 (GYS1) AND METHODS OF USE THEREOF Maze Therapeutics, Inc. (US) 2024-01-24 — — EP disclosed
WO-2022198196-A1 INHIBITORS OF GLYCOGEN SYNTHASE 1 (GYS1) AND METHODS OF USE THEREOF MAZE THERAPEUTICS, INC. (US) 2022-09-22 — — WO disclosed
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