SCHEMBL29820569

SCHEMBL29820569

Cc1coc(CC(=O)N2CC(F)CC2C(=O)NC(c2ccccc2)c2ccc(C3CC(F)(F)C3)cn2)n1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 11/20 0.37
▸ PSMB9 P28065 1/20 0.34
▸ EP300 Q09472 2/20 0.32
▸ CREBBP Q92793 1/20 0.32
▸ XIAP P98170 4/20 0.32
▸ BIRC3 Q13489 4/20 0.32
▸ BIRC2 Q13490 4/20 0.32
▸ BIRC8 Q96P09 1/20 0.32
▸ ITGA4 P13612 2/20 0.32

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
SCHEMBL24665847 1.00 CFD (0.37) CFDPSMB9EP300CREBBPXIAP
SCHEMBL29231397 1.00 CFD (0.37) CFDPSMB9EP300CREBBPXIAP
SCHEMBL30341422 1.00 CFD (0.37) CFDPSMB9EP300CREBBPXIAP
SCHEMBL29230992 0.92 CFD (0.33) CFDPSMB9EP300CREBBP
SCHEMBL24666119 0.92 CFD (0.33) CFDPSMB9EP300CREBBP
SCHEMBL30341333 0.92 CFD (0.33) CFDPSMB9EP300CREBBP
SCHEMBL29820257 0.92 CFD (0.33) CFDPSMB9EP300CREBBP
SCHEMBL24665540 0.90 CFD (0.36) CFDPSMB9EP300ITGA4
SCHEMBL29820571 0.90 CFD (0.36) CFDPSMB9EP300ITGA4
SCHEMBL30341279 0.90 CFD (0.36) CFDPSMB9EP300ITGA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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