SCHEMBL30648558

SCHEMBL30648558

COc1cc(O)c(O)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.58
HMGCR P04035 2/20 0.56
MAOB P27338 1/20 0.52
CYP3A4 P08684 4/20 0.50
MAPT P10636 3/20 0.50
TP53 P04637 3/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
TSHR P16473 1/20 0.50
ALOX15 P16050 3/20 0.48
LMNA P02545 2/20 0.48
HPGD P15428 2/20 0.48
ALOX12 P18054 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.48
EP300 Q09472 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PTGS2 P35354 1/20 0.44

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
SCHEMBL1987450 1.00 HTT (0.58) HTTHMGCRMAOBCYP3A4MAPT
SCHEMBL11233383 0.88 MAOB (0.54) HTTHMGCRMAOBCYP3A4MAPT
SCHEMBL1402467 0.88 MAOB (0.54) HTTHMGCRMAOBCYP3A4MAPT
SCHEMBL69624 0.87 MAOB (0.59) HTTHMGCRMAOBCYP3A4MAPT
SCHEMBL18888112 0.85 HTT (0.46) HTTHMGCRMAOBCYP3A4MAPT
SCHEMBL29421900 0.83 HTT (0.50) HTTHMGCRMAOBCYP3A4MAPT
SCHEMBL17577763 0.83 CYP3A4 (0.45) HTTHMGCRMAOBCYP3A4MAPT
SCHEMBL31432508 0.81 ALOX5 (0.50) HTTHMGCRMAOBALOX15ALOX12
SCHEMBL11940266 0.81 HTT (0.48) HTTHMGCRMAOBCYP3A4MAPT
SCHEMBL29560669 0.81 LCK (0.52) HTTHMGCRMAOBMAPTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116948583-B Preparation method and application of mildew-proof antibacterial epoxy resin-starch adhesive 广东晋泽科技有限公司 2024-01-23 CN claimed
CN-116948583-A Preparation method and application of mildew-proof antibacterial epoxy resin-starch adhesive 广东晋泽科技有限公司 2023-10-27 CN claimed
CN-119236012-A Ointment for treating diarrhea type irritable bowel syndrome and preparation method thereof 山东中医药大学附属医院 2025-01-03 CN disclosed
CN-116948583-B Preparation method and application of mildew-proof antibacterial epoxy resin-starch adhesive 广东晋泽科技有限公司 2024-01-23 CN disclosed
CN-116948583-A Preparation method and application of mildew-proof antibacterial epoxy resin-starch adhesive 广东晋泽科技有限公司 2023-10-27 CN disclosed