SCHEMBL30350358

SCHEMBL30350358

COCOc1cc(O)c2c(c1)OC(c1cc(OCc3ccccc3)c(OCc3ccccc3)c(OCc3ccccc3)c1)C(O)C2O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 1/20 0.42
▸ STING1 Q86WV6 1/20 0.38
▸ LMNA P02545 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAOB P27338 2/20 0.34
▸ SIRT1 Q96EB6 1/20 0.33
▸ BCHE P06276 2/20 0.33
▸ ACHE P22303 2/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33
▸ MGAM O43451 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ SI P14410 1/20 0.32
▸ MGAM2 Q2M2H8 1/20 0.32

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
SCHEMBL23202737 1.00 XDH (0.42) XDHSTING1LMNAHPGDMAOB
SCHEMBL30350473 0.87 XDH (0.57) XDHSTING1LMNAHPGDMAOB
SCHEMBL21588095 0.87 XDH (0.57) XDHSTING1LMNAHPGDMAOB
SCHEMBL23202731 0.83 XDH (0.50) XDHLMNAHPGDGAA
SCHEMBL30350360 0.83 XDH (0.50) XDHLMNAHPGDGAA
SCHEMBL30350345 0.82 PTGS1 (0.49) STING1HPGDMGAMGAASI
SCHEMBL23202736 0.82 PTGS1 (0.49) STING1HPGDMGAMGAASI
SCHEMBL23202784 0.79 ABCB1 (0.52) STING1
SCHEMBL30350408 0.79 ABCB1 (0.52) STING1
SCHEMBL23202777 0.77 ABCB1 (0.58) STING1

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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