SCHEMBL430372

SCHEMBL430372

C1=Cc2cc3ccc([nH]3)c(-c3ccc4ccc5cccc6ccc3c4c56)c3nc(cc4ccc(cc1n2)[nH]4)C=C3

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.50
▸ STAT1 P42224 1/20 0.50
▸ ERBB2 P04626 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ AHR P35869 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
SCHEMBL226507 0.96 STAT3 (0.48) STAT3STAT1ERBB2CYP1A2FYN
SCHEMBL226506 0.86 STAT3 (0.35) STAT3STAT1ERBB2CYP1A2FYN
SCHEMBL11328879 0.84 STAT3 (0.56) STAT3STAT1
SCHEMBL6014814 0.83 STAT3 (0.50) STAT3STAT1
SCHEMBL430371 0.83 STAT3 (0.34) STAT3STAT1ERBB2CYP1A2FYN
SCHEMBL27826953 0.82 STAT3 (0.49) STAT3STAT1
SCHEMBL6152402 0.82 STAT3 (0.49) STAT3STAT1
SCHEMBL27806718 0.82 STAT3 (0.49) STAT3STAT1
SCHEMBL224502 0.82 TERT (0.39) —
SCHEMBL28501396 0.81 STAT3 (0.33) STAT3STAT1ERBB2CYP1A2FYN

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
EP-2590983-A2 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRIC APPLICATIONS The University Of Southern California (US) 2013-05-15 — — EP disclosed
WO-2012012117-A2 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRIC APPLICATIONS The University of Southern California USC Stevens Institute for Innovation (US) 2012-01-26 — — WO disclosed
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