SCHEMBL14818489

SCHEMBL14818489

C=Cc1ccc(-c2c3nc(cc4ccc([nH]4)c(-c4ccc(N)cc4)c4nc(cc5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.56
▸ STAT1 P42224 1/20 0.56
▸ TOP1 P11387 4/20 0.48
▸ CYCS P99999 3/20 0.35
▸ ENPP2 Q13822 1/20 0.34
▸ TERT O14746 3/20 0.34
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ GLA P06280 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ RECQL P46063 2/20 0.33
▸ RXFP1 Q9HBX9 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ GFER P55789 1/20 0.33
▸ CYP3A4 P08684 2/20 0.32

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
SCHEMBL19670048 0.92 STAT3 (0.51) STAT3STAT1TOP1CYCSENPP2
SCHEMBL7258061 0.87 STAT3 (0.64) STAT3STAT1TOP1CYCSENPP2
SCHEMBL10100940 0.87 STAT3 (0.64) STAT3STAT1TOP1CYCSENPP2
SCHEMBL30372046 0.87 STAT3 (0.64) STAT3STAT1TOP1CYCSENPP2
SCHEMBL27992764 0.86 STAT3 (0.63) STAT3STAT1TOP1CYCSENPP2
SCHEMBL29823978 0.86 STAT3 (0.62) STAT3STAT1TOP1CYCSENPP2
SCHEMBL3995625 0.85 STAT3 (0.78) STAT3STAT1TOP1CYCSENPP2
SCHEMBL1863470 0.83 STAT3 (0.59) STAT3STAT1TOP1CYCSENPP2
SCHEMBL7257316 0.81 STAT3 (0.56) STAT3STAT1TOP1CYCSENPP2
SCHEMBL7257952 0.81 STAT3 (0.56) STAT3STAT1TOP1CYCSENPP2

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-20130074920-A1 Photo-Switchable Fullerene-Based Materials as Interfacial Layers in Organic Photovoltaics BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-03-28 — — US disclosed
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