SCHEMBL27689652

SCHEMBL27689652

O=COc1cc2cc3nc(cc4ccc(cc5nc(cc1[nH]2)C=C5)[nH]4)C=C3

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.35
▸ STAT1 P42224 1/20 0.35
▸ CBFB Q13951 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
SCHEMBL480532 0.80 STAT3 (0.37) STAT3STAT1
SCHEMBL30497518 0.80 STAT3 (0.37) STAT3STAT1
SCHEMBL28470756 0.78 STAT3 (0.36) STAT3STAT1
SCHEMBL31541144 0.77 TYMS (0.32) STAT3STAT1
Formic Acid Phenyl Ester SCHEMBL28307260 0.77 CBFB (0.39) STAT3STAT1CBFB
SCHEMBL352668 0.76 STAT3 (0.37) STAT3STAT1
SCHEMBL164026 0.76 STAT3 (0.41) STAT3STAT1
Formic Acid SCHEMBL27490312 0.75 STAT3 (0.36) STAT3STAT1
SCHEMBL29267780 0.75 STAT3 (0.36) STAT3STAT1
SCHEMBL27728578 0.75 STAT3 (0.36) 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-1980600-A Synthesis of porphyrins designed for attachment to electroactive surfaces via one or more carbon tethers UNIV NORTH CAROLINA (US) 2007-06-13 — — CN disclosed
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