SCHEMBL28640368

SCHEMBL28640368

OC1(c2ccccc2)C=CC(S)=CC1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRK1 P41145 1/20 0.30
OPRL1 P41146 1/20 0.30

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
SCHEMBL2149953 0.79 HDAC4 (0.31) HDAC4OPRM1OPRK1OPRL1
SCHEMBL1477275 0.78 MAOB (0.31) HDAC4OPRM1OPRK1OPRL1
SCHEMBL9547933 0.76 HDAC1 (0.34)
SCHEMBL11765982 0.76
SCHEMBL27516779 0.75 CCR2 (0.36) HDAC4OPRM1OPRL1
SCHEMBL27839293 0.73 HDAC4 (0.41) HDAC4OPRM1OPRK1OPRL1
SCHEMBL29034394 0.71 ALDH1A1 (0.39) HDAC4
SCHEMBL9486983 0.70 MMP3 (0.41)
SCHEMBL4089733 0.67 HDAC4 (0.36) HDAC4OPRM1OPRK1OPRL1
SCHEMBL31472283 0.66 SLC7A5 (0.44)

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
CN-110499644-B Method for preparing antibacterial textile finishing agent by using ursolic acid extract 浙江理工大学 2021-10-26 CN claimed
CN-110499644-B Method for preparing antibacterial textile finishing agent by using ursolic acid extract 浙江理工大学 2021-10-26 CN disclosed