SCHEMBL30760595

SCHEMBL30760595

BC(B)(OC(=O)/C=C\C(=O)O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 8/20 0.46
KDM4E B2RXH2 3/20 0.40
MAPT P10636 3/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HDAC3 O15379 1/20 0.38
TNKS O95271 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
ALDH1A1 P00352 5/20 0.36
CYP2C19 P33261 2/20 0.35

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
SCHEMBL30139633 1.00 HCAR2 (0.46) HCAR2KDM4EMAPTHPGDHSD17B10
SCHEMBL2962181 0.80 HCAR2 (0.49) HCAR2KDM4EMAPTHPGDHSD17B10
SCHEMBL28803460 0.80 HCAR2 (0.49) HCAR2KDM4EMAPTHPGDHSD17B10
SCHEMBL2962178 0.80 HCAR2 (0.49) HCAR2KDM4EMAPTHPGDHSD17B10
SCHEMBL7086340 0.79 HCAR2 (0.47) HCAR2KDM4EMAPTHPGDHSD17B10
SCHEMBL7087313 0.79 HCAR2 (0.47) HCAR2KDM4EMAPTHPGDHSD17B10
SCHEMBL7083020 0.79 HCAR2 (0.46) HCAR2KDM4EMAPTHPGDHSD17B10
SCHEMBL7083026 0.79 HCAR2 (0.46) HCAR2KDM4EMAPTHPGDHSD17B10
SCHEMBL7086342 0.79 HCAR2 (0.47) HCAR2KDM4EMAPTHPGDHSD17B10
SCHEMBL7088968 0.79 HCAR2 (0.46) HCAR2KDM4EMAPTHPGDHSD17B10

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-2024019111-A1 LEVELING AGENT FOR COATING MATERIAL, AND COATING MATERIAL COMPOSITION 楠本化成株式会社 2024-01-25 WO disclosed