SCHEMBL9450931

SCHEMBL9450931

O=C(O)Cc1c2nc(cc3ccc(cc4nc(cc5ccc1[nH]5)C=C4)[nH]3)C=C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.46
▸ STAT1 P42224 1/20 0.46
▸ KDM4E B2RXH2 5/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ GAA P10253 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HPGD P15428 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ AKR1C2 P52895 1/20 0.33
▸ PPARG P37231 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ LCK P06239 1/20 0.32
▸ PRKACA P17612 1/20 0.32
▸ CSNK2A2 P19784 1/20 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
SCHEMBL4410064 0.83 STAT3 (0.47) STAT3STAT1
SCHEMBL14867477 0.83 STAT3 (0.49) STAT3STAT1
SCHEMBL5533945 0.83 STAT3 (0.49) STAT3STAT1
SCHEMBL18229762 0.82 STAT3 (0.44) STAT3STAT1KDM4EALDH1A1HPGD
SCHEMBL5585185 0.81 STAT3 (0.45) STAT3STAT1
SCHEMBL144247 0.80 STAT3 (0.47) STAT3STAT1
SCHEMBL460386 0.80 STAT3 (0.47) STAT3STAT1
SCHEMBL8172533 0.80 STAT3 (0.47) STAT3STAT1
SCHEMBL3125425 0.79 STAT3 (0.49) STAT3STAT1TOP1CYCS
SCHEMBL9450936 0.79 STAT3 (0.37) STAT3STAT1KDM4EALDH1A1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0535133-A4 ANALYTICAL TEST DEVICES FOR COMPETITION ASSAY FOR DRUGS OF NON-PROTEIN ANTIGENS USING IMMUNOCHROMATOGRAPHIC TECHNIQUES — 1993-11-24 — — EP disclosed
EP-0535133-A1 ANALYTICAL TEST DEVICES FOR COMPETITION ASSAY FOR DRUGS OF NON-PROTEIN ANTIGENS USING IMMUNOCHROMATOGRAPHIC TECHNIQUES DRUG SCREENING SYSTEMS, INC. (US) 1993-04-07 — — EP disclosed
WO-1991019980-A1 ANALYTICAL TEST DEVICES FOR COMPETITION ASSAY FOR DRUGS OF NON-PROTEIN ANTIGENS USING IMMUNOCHROMATOGRAPHIC TECHNIQUES DRUG SCREENING SYSTEMS, INC. (US) 1991-12-26 — — WO disclosed
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