SCHEMBL28459011

SCHEMBL28459011

Oc1ccc(-c2c3nc(cc4ccc(cc5nc(cc6ccc2[nH]6)C=C5)[nH]4)C=C3)cc1.[Zn]

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.63
▸ STAT1 P42224 1/20 0.63
▸ TOP1 P11387 4/20 0.43
▸ CYCS P99999 3/20 0.42
▸ ENPP2 Q13822 1/20 0.41
▸ TERT O14746 3/20 0.38
▸ ABCG2 Q9UNQ0 1/20 0.36
▸ CDK5 Q00535 3/20 0.35
▸ CDK5R1 Q15078 3/20 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
SCHEMBL29402399 1.00 STAT3 (0.63) STAT3STAT1TOP1CYCSENPP2
SCHEMBL29403134 0.99 STAT3 (0.64) STAT3STAT1TOP1CYCSENPP2
SCHEMBL3352961 0.99 STAT3 (0.64) STAT3STAT1TOP1CYCSENPP2
SCHEMBL14973450 0.97 STAT3 (0.63) STAT3STAT1TOP1CYCSENPP2
SCHEMBL585640 0.96 STAT3 (0.68) STAT3STAT1TOP1CYCSENPP2
Zinc Ion SCHEMBL31127546 0.94 STAT3 (0.66) STAT3STAT1TOP1CYCSENPP2
SCHEMBL4109027 0.87 STAT3 (0.57) STAT3STAT1TOP1CYCSENPP2
SCHEMBL4124090 0.87 STAT3 (0.57) STAT3STAT1TOP1CYCSENPP2
SCHEMBL1275381 0.86 STAT3 (0.84) STAT3STAT1TOP1CYCSENPP2
SCHEMBL7258061 0.85 STAT3 (0.64) STAT3STAT1TOP1CYCSENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111617644-B Preparation method of monolithic polyaryletherketone bipolar membrane with side chain containing porphyrin water dissociation catalytic group 福建师范大学 2022-03-15 — — CN disclosed
CN-111617644-A Preparation method of monolithic polyaryletherketone bipolar membrane with side chain containing porphyrin water dissociation catalytic group 福建师范大学 2020-09-04 — — CN disclosed
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