SCHEMBL29820580

SCHEMBL29820580

CC(C)c1ccc(C(NC(=O)C2CC(F)CN2C(=O)Cc2nn(C)c(=O)o2)c2ccccc2)nc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 12/20 0.35
▸ PSMB9 P28065 1/20 0.34
▸ XIAP P98170 4/20 0.33
▸ BIRC3 Q13489 4/20 0.33
▸ BIRC2 Q13490 4/20 0.33
▸ BIRC8 Q96P09 1/20 0.33
▸ ITGA4 P13612 2/20 0.33
▸ DRD2 P14416 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
SCHEMBL24664618 1.00 CFD (0.35) CFDPSMB9XIAPBIRC3BIRC2
SCHEMBL24665687 0.88 CFD (0.36) CFDPSMB9DRD2
SCHEMBL29230886 0.88 CFD (0.36) CFDPSMB9DRD2
SCHEMBL29820279 0.88 GPR88 (0.36) CFDPSMB9ITGA4
SCHEMBL24664659 0.88 GPR88 (0.36) CFDPSMB9ITGA4
SCHEMBL24666300 0.87 CFD (0.35) CFDPSMB9XIAPBIRC3BIRC2
SCHEMBL29230621 0.87 CFD (0.35) CFDPSMB9XIAPBIRC3BIRC2
SCHEMBL24666481 0.87 CFD (0.37) CFDPSMB9DRD2
SCHEMBL29820240 0.87 CFD (0.37) CFDPSMB9DRD2
SCHEMBL26833084 0.86 CFD (0.41) CFDXIAPBIRC3BIRC2BIRC8

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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