SCHEMBL28613259

SCHEMBL28613259

O=S(=O)(O)c1ccc(C2=C([Mn])C3=NC2=CC2=NC(=CC4=NC(=CC5=NC(=C3)C=C5)C=C4)C=C2)cc1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 1/20 0.31

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
SCHEMBL9591258 0.85 TSHR (0.35) —
SCHEMBL28401041 0.81 BCL2L1 (0.31) —
SCHEMBL29286965 0.80 — —
SCHEMBL28587239 0.77 ENPP2 (0.32) ENPP2
SCHEMBL499072 0.76 ENPP2 (0.33) ENPP2
SCHEMBL11429000 0.75 ENPP2 (0.33) ENPP2
Water SCHEMBL28884512 0.75 ENPP2 (0.33) ENPP2
SCHEMBL28425056 0.75 ENPP2 (0.33) ENPP2
Hydrochloric Acid SCHEMBL8585892 0.75 ENPP2 (0.33) ENPP2
SCHEMBL8167637 0.74 ENPP2 (0.32) ENPP2

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-113150055-A High-efficiency synthesis method of stigmasterol ester 右江民族医学院 2021-07-23 — — CN disclosed
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