SCHEMBL30767176

SCHEMBL30767176

Brc1c2nc(c(-c3ccccc3)c3ccc(cc4nc(c(-c5ccccc5)c5ccc1[nH]5)C=C4)[nH]3)C=C2

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.74
▸ STAT1 P42224 1/20 0.74
▸ TOP1 P11387 4/20 0.43
▸ CYCS P99999 3/20 0.42
▸ TERT O14746 4/20 0.41
▸ ENPP2 Q13822 1/20 0.39
▸ ABCG2 Q9UNQ0 1/20 0.34

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
SCHEMBL2940532 1.00 STAT3 (0.74) STAT3STAT1TOP1CYCSTERT
SCHEMBL5134031 1.00 STAT3 (0.74) STAT3STAT1TOP1CYCSTERT
SCHEMBL5011931 1.00 STAT3 (0.74) STAT3STAT1TOP1CYCSTERT
SCHEMBL5134266 0.99 STAT3 (0.72) STAT3STAT1TOP1CYCSTERT
SCHEMBL5013665 0.96 STAT3 (0.71) STAT3STAT1TOP1CYCSTERT
SCHEMBL30293296 0.92 STAT3 (0.86) STAT3STAT1TOP1CYCSTERT
SCHEMBL31550992 0.92 STAT3 (0.86) STAT3STAT1TOP1CYCSTERT
SCHEMBL1224432 0.92 STAT3 (0.86) STAT3STAT1TOP1CYCSTERT
SCHEMBL31324939 0.91 STAT3 (0.84) STAT3STAT1TOP1CYCSTERT
SCHEMBL31324940 0.91 STAT3 (0.84) STAT3STAT1TOP1CYCSTERT

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-110730782-B Photodynamic therapy compounds and photodynamic therapy methods 光盐生物科技有限公司 2024-01-02 — — CN disclosed
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