SCHEMBL28586570

SCHEMBL28586570

Oc1cc(O)cc(-c2cc3cc4nc(cc5ccc(cc6nc(cc2[nH]3)C=C6)[nH]5)C=C4)c1.[Zn]

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.37
▸ STAT1 P42224 1/20 0.37
▸ ABL1 P00519 1/20 0.31
▸ ABCB1 P08183 1/20 0.31
▸ BCR P11274 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
SCHEMBL28590232 0.98 STAT3 (0.38) STAT3STAT1ABL1ABCB1BCR
SCHEMBL3352970 0.87 STAT3 (0.38) STAT3STAT1
SCHEMBL29960178 0.87 STAT3 (0.38) STAT3STAT1
SCHEMBL3107265 0.86 MGAM (0.41) STAT3STAT1
Hydrochloric Acid SCHEMBL27597697 0.85 STAT3 (0.37) STAT3STAT1
SCHEMBL28295368 0.85 STAT3 (0.37) STAT3STAT1
Hydrochloric Acid SCHEMBL27597700 0.85 STAT3 (0.37) STAT3STAT1
SCHEMBL14973447 0.85 STAT3 (0.37) STAT3STAT1
SCHEMBL28351284 0.85 STAT3 (0.37) STAT3STAT1
SCHEMBL28670273 0.83 STAT3 (0.35) STAT3STAT1

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-107407621-B Sensor with porous or granular material as receptor layer 国立研究开发法人物质材料研究机构 2021-02-09 — — CN disclosed
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