SCHEMBL30574304

SCHEMBL30574304

CC(=O)N1c2ccc(F)cc2N(C(=O)OC(C)(C)C)C[C@@H]1C

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 14/20 0.47
NOTUM Q6P988 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL17018036 0.86 BRD4 (0.47) BRD4NOTUM
SCHEMBL16722597 0.84 BRD4 (0.59) BRD4NOTUM
SCHEMBL16722595 0.84 BRD4 (0.59) BRD4NOTUM
SCHEMBL26130362 0.82 BRD4 (0.48) BRD4NOTUM
SCHEMBL26130366 0.82 BRD4 (0.48) BRD4NOTUM
SCHEMBL30574298 0.79 USP30 (0.42) BRD4
SCHEMBL16721427 0.76 USP30 (0.41) BRD4
SCHEMBL16721428 0.76 USP30 (0.41) BRD4
SCHEMBL16721274 0.75 USP30 (0.43) BRD4
SCHEMBL16721279 0.75 USP30 (0.43) BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023196512-A1 PROPARGYL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THAT MODULATE BRD4 Plexium, Inc. (US) 2023-10-12 WO disclosed