SCHEMBL28217323

SCHEMBL28217323

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.Oc1ccc([Mn])cc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.33
▸ STAT1 P42224 1/20 0.33
▸ ACHE P22303 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ALOX12 P18054 1/20 0.30
▸ APOBEC3G Q9HC16 1/20 0.30

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
SCHEMBL30023006 0.82 STAT3 (0.41) STAT3STAT1
SCHEMBL28163063 0.82 STAT3 (0.33) STAT3STAT1ALDH1A1GAAPKM
SCHEMBL28371785 0.82 STAT3 (0.33) STAT3STAT1ALDH1A1GAAPKM
SCHEMBL28799105 0.82 KDM4E (0.34) STAT3STAT1ACHEALDH1A1GAA
SCHEMBL29145276 0.82 STAT3 (0.33) STAT3STAT1ALDH1A1GAAPKM
SCHEMBL28355301 0.82 STAT3 (0.33) STAT3STAT1ALDH1A1GAAPKM
SCHEMBL29145240 0.82 STAT3 (0.33) STAT3STAT1ALDH1A1GAAPKM
Phenol SCHEMBL28121654 0.81 STAT3 (0.44) STAT3STAT1
SCHEMBL28219212 0.81 STAT3 (0.44) STAT3STAT1
Phenol SCHEMBL27333276 0.81 STAT3 (0.44) 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-108097318-A Graphene oxide immobilized four(4- hydroxy phenyls)The preparation method and catalytic applications of manganoporphyrin catalysis material 广西大学 2018-06-01 — — CN disclosed
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