SCHEMBL28679547

SCHEMBL28679547

Nc1c(N)c2cc3nc(cc4ccc(cc5nc(cc1[nH]2)C=C5)[nH]4)C=C3.[Zn]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.37
▸ STAT1 P42224 1/20 0.37
▸ MEN1 O00255 3/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ USP2 O75604 2/20 0.31
▸ POLB P06746 2/20 0.31
▸ BLM P54132 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ GAA P10253 1/20 0.31
▸ GMNN O75496 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ NFKB1 P19838 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
SCHEMBL30464735 1.00 STAT3 (0.37) STAT3STAT1MEN1KMT2AUSP2
SCHEMBL1343983 0.98 STAT3 (0.38) STAT3STAT1MEN1KMT2AUSP2
SCHEMBL28501603 0.96 STAT3 (0.37) STAT3STAT1MEN1KMT2AUSP2
SCHEMBL28973498 0.85 STAT3 (0.41) STAT3STAT1
SCHEMBL78009 0.85 STAT3 (0.41) STAT3STAT1
SCHEMBL6034867 0.85 STAT3 (0.41) STAT3STAT1
SCHEMBL31208070 0.85 STAT3 (0.41) STAT3STAT1
SCHEMBL29163234 0.85 STAT3 (0.41) STAT3STAT1
Hydrochloric Acid SCHEMBL11327619 0.83 STAT3 (0.40) STAT3STAT1
Iodide SCHEMBL11328134 0.83 STAT3 (0.40) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113845900-B Porphyrin dimer graphene nonlinear composite material and preparation and application thereof 同济大学 2023-06-02 — — CN claimed
CN-113845900-A Porphyrin dimer graphene nonlinear composite material and preparation and application thereof 同济大学 2021-12-28 — — CN claimed
CN-113845900-B Porphyrin dimer graphene nonlinear composite material and preparation and application thereof 同济大学 2023-06-02 — — CN disclosed
CN-113845900-A Porphyrin dimer graphene nonlinear composite material and preparation and application thereof 同济大学 2021-12-28 — — CN disclosed
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