SCHEMBL31296593

SCHEMBL31296593

Oc1cccc(-c2c3nc(c(-c4cccc(O)c4)c4ccc([nH]4)c(-c4cccc(O)c4)c4nc(c(-c5cccc(O)c5)c5ccc2[nH]5)C=C4)C=C3)c1

nearest known ligand 0.97

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 2/20 0.50
▸ CYCS P99999 3/20 0.49
▸ TERT O14746 3/20 0.49
▸ ENPP2 Q13822 1/20 0.48
▸ STAT3 P40763 1/20 0.47
▸ STAT1 P42224 1/20 0.47
▸ HSD17B1 P14061 1/20 0.44
▸ HSD17B2 P37059 1/20 0.44
▸ RIPK1 Q13546 1/20 0.44
▸ MGAM O43451 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ SI P14410 1/20 0.43
▸ MGAM2 Q2M2H8 1/20 0.43

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
SCHEMBL29556430 1.00 TOP1 (0.50) TOP1CYCSTERTENPP2STAT3
SCHEMBL249199 1.00 TOP1 (0.50) TOP1CYCSTERTENPP2STAT3
SCHEMBL29648445 0.98 TERT (0.51) TOP1CYCSTERTENPP2STAT3
SCHEMBL8865323 0.98 TERT (0.51) TOP1CYCSTERTENPP2STAT3
SCHEMBL30297908 0.98 TERT (0.51) TOP1CYCSTERTENPP2STAT3
SCHEMBL1640992 0.95 TOP1 (0.54) TOP1CYCSTERTENPP2STAT3
Temoporfin SCHEMBL6422 0.90 TOP1 (0.43) TOP1CYCSTERTENPP2STAT3
SCHEMBL5100886 0.90 TOP1 (0.43) TOP1CYCSTERTENPP2STAT3
SCHEMBL17651778 0.90 TOP1 (0.43) TOP1CYCSTERTENPP2STAT3
SCHEMBL17651811 0.90 TOP1 (0.43) TOP1CYCSTERTENPP2STAT3

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-119223945-A High-temperature Daqu liquor identification method based on porphyrin catalyst quasi-peroxidase activity oxidation TMB color change 中南民族大学 2024-12-31 — — CN disclosed
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