SCHEMBL28804385

SCHEMBL28804385

C=C(C)C(=O)ONC(=O)Nc1cc(-c2ccccc2)ccc1O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 18/20 0.62
KDM4E B2RXH2 1/20 0.62
APOBEC3A P31941 1/20 0.62
GFER P55789 1/20 0.62
APOBEC3G Q9HC16 1/20 0.62
HDAC2 Q92769 2/20 0.53
HDAC3 O15379 2/20 0.47
PDPK1 O15530 1/20 0.46
AKT1 P31749 1/20 0.46
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45

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
SCHEMBL28804257 0.84 RAB9A (0.49) HDAC1KDM4EHDAC2HDAC3
SCHEMBL3249615 0.83 HDAC1 (0.56) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL28804296 0.83 GAA (0.51)
SCHEMBL3251760 0.81 HDAC1 (0.54) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL28804238 0.81 HDAC1 (0.56) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL5705906 0.80 HDAC1 (0.58) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL3249553 0.79 HDAC1 (0.51) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL28804252 0.79 CA12 (0.48) HDAC1KDM4EHDAC2HDAC3
SCHEMBL4665439 0.77 HDAC1 (1.00) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL5705872 0.77 HDAC1 (0.54) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G

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
CN-109791361-B Positive lithographic printing plate precursor, method for producing same, and method for producing lithographic printing plate 富士胶片株式会社 2022-06-03 CN disclosed