SCHEMBL9588222

SCHEMBL9588222

Fc1ccc(-c2c3nc(cc4ccc(cc5nc(cc6c(-c7ccccn7)c(-c7ccccn7)c2n6-c2ccccn2)C=C5)[nH]4)C=C3)cc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.38
▸ STAT1 P42224 1/20 0.38
▸ SLC11A2 P49281 1/20 0.35
▸ METAP2 P50579 1/20 0.33
▸ METAP1 P53582 1/20 0.33
▸ CBFB Q13951 1/20 0.33
▸ TGFBR1 P36897 5/20 0.32
▸ THRB P10828 1/20 0.32
▸ MAPK14 Q16539 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ DCTPP1 Q9H773 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
SCHEMBL3261540 0.91 STAT3 (0.38) STAT3STAT1CBFB
SCHEMBL28584534 0.90 STAT3 (0.37) STAT3STAT1METAP2METAP1CBFB
SCHEMBL5798442 0.90 STAT3 (0.37) STAT3STAT1CBFB
SCHEMBL7571349 0.90 STAT3 (0.37) STAT3STAT1CBFB
SCHEMBL6764274 0.90 STAT3 (0.37) STAT3STAT1CBFB
SCHEMBL28399602 0.90 STAT3 (0.37) STAT3STAT1CBFB
SCHEMBL5796219 0.90 STAT3 (0.37) STAT3STAT1CBFB
SCHEMBL28752550 0.89 STAT3 (0.37) STAT3STAT1
SCHEMBL28247729 0.89 STAT3 (0.37) STAT3STAT1
SCHEMBL14080381 0.87 STAT3 (0.45) STAT3STAT1SLC11A2

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
US-5268371-A Derivatives of porphyrin and metalloporphyrins optionally coupled to a biologically active molecule and pharmaceutical composition containing them CIS BIO INTERNATIONAL (FR) 1993-12-07 — — US disclosed
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