SCHEMBL31384904

SCHEMBL31384904

Nc1c(-c2ccccc2)c2cc3nc(cc4ccc(cc5nc(cc1[nH]2)C=C5)[nH]4)C=C3.[Ni]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.51
▸ STAT1 P42224 1/20 0.51
▸ ALDH1A1 P00352 6/20 0.38
▸ SMN1; SMN2 Q16637 5/20 0.38
▸ KDM4E B2RXH2 5/20 0.38
▸ NPC1 O15118 5/20 0.38
▸ RAB9A P51151 5/20 0.38
▸ HPGD P15428 4/20 0.38
▸ TP53 P04637 2/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ PRMT1 Q99873 1/20 0.38
▸ MAPT P10636 4/20 0.36
▸ GAA P10253 3/20 0.36
▸ GFER P55789 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ GLA P06280 1/20 0.36
▸ RCE1 Q9Y256 1/20 0.36
▸ MEN1 O00255 5/20 0.35
▸ KMT2A Q03164 5/20 0.35
▸ XDH P47989 2/20 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
SCHEMBL28267206 1.00 STAT3 (0.51) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL31435710 0.99 STAT3 (0.52) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL31435711 0.99 STAT3 (0.52) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL5067206 0.99 STAT3 (0.52) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL11498911 0.97 STAT3 (0.51) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL31435707 0.97 STAT3 (0.51) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL28088145 0.97 STAT3 (0.51) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL31384898 0.97 STAT3 (0.51) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL28218443 0.97 STAT3 (0.51) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL226837 0.88 STAT3 (0.59) STAT3STAT1ALDH1A1SMN1; SMN2KDM4E

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-119569742-A Porphyrin compound and perovskite solar cell comprising same 兰州大学 2025-03-07 — — CN disclosed
CN-119530876-A Composite catalyst, electrode carrying composite catalyst, and preparation method and application of electrode 中国石油化工股份有限公司 2025-02-28 — — CN disclosed
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