SCHEMBL29820571

SCHEMBL29820571

Cc1cnc(CC(=O)N2CC(F)CC2C(=O)NC(c2ccccc2)c2ccc(C3CC(F)(F)C3)cn2)o1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 11/20 0.36
▸ PSMB9 P28065 1/20 0.35
▸ GPR88 Q9GZN0 1/20 0.32
▸ ITGA4 P13612 2/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ DRD3 P35462 1/20 0.32
▸ CCNE1 P24864 3/20 0.32
▸ CDK2 P24941 3/20 0.32
▸ EP300 Q09472 1/20 0.32
▸ GSK3B P49841 1/20 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
SCHEMBL24665540 1.00 CFD (0.36) CFDPSMB9GPR88ITGA4DRD2
SCHEMBL30341279 1.00 CFD (0.36) CFDPSMB9GPR88ITGA4DRD2
SCHEMBL29230579 1.00 CFD (0.36) CFDPSMB9GPR88ITGA4DRD2
SCHEMBL29231397 0.90 CFD (0.37) CFDPSMB9ITGA4EP300
SCHEMBL24665847 0.90 CFD (0.37) CFDPSMB9ITGA4EP300
SCHEMBL30341422 0.90 CFD (0.37) CFDPSMB9ITGA4EP300
SCHEMBL29820569 0.90 CFD (0.37) CFDPSMB9ITGA4EP300
SCHEMBL24665846 0.88 CFD (0.35) CFDPSMB9DRD2EP300
SCHEMBL30341463 0.88 CFD (0.35) CFDPSMB9DRD2EP300
SCHEMBL29231069 0.88 CFD (0.35) CFDPSMB9DRD2EP300

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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