SCHEMBL30350473

SCHEMBL30350473

Oc1cc(O)c2c(c1)OC(c1cc(OCc3ccccc3)c(OCc3ccccc3)c(OCc3ccccc3)c1)C(O)C2O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 2/20 0.57
▸ BCHE P06276 2/20 0.39
▸ ACHE P22303 2/20 0.39
▸ SIRT1 Q96EB6 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ STING1 Q86WV6 1/20 0.36
▸ MAOB P27338 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ SNCA P37840 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ HSD17B10 Q99714 1/20 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
SCHEMBL21588095 1.00 XDH (0.57) XDHBCHEACHESIRT1PTPN1
SCHEMBL23202737 0.87 XDH (0.42) XDHBCHEACHESIRT1PTPN1
SCHEMBL30350358 0.87 XDH (0.42) XDHBCHEACHESIRT1PTPN1
SCHEMBL21722582 0.85 XDH (0.50) XDHBCHELMNAHPGDALOX15
SCHEMBL21722488 0.83 XDH (0.48) XDHBCHEACHELMNAHPGD
SCHEMBL21588097 0.81 XDH (0.59) XDHLMNAHPGDCYP1A2ALOX15
SCHEMBL30350317 0.81 XDH (0.59) XDHLMNAHPGDCYP1A2ALOX15
SCHEMBL26481115 0.80 XDH (0.57) XDHSNCACYP1A2ALOX15HSD17B10
SCHEMBL30350384 0.79 PTGS1 (0.58) STING1HPGDSNCAALOX15HSD17B10
SCHEMBL21588096 0.79 PTGS1 (0.58) STING1HPGDSNCAALOX15HSD17B10

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-110183431-B Compound for treating or preventing liver diseases 江苏新元素医药科技有限公司 2023-04-11 — — CN disclosed
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