SCHEMBL14030998

SCHEMBL14030998

O=C(Nc1ccc(Sc2ccccc2)c2c1C(=O)c1ccccc1C2=O)c1ccccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.47
▸ HTT P42858 3/20 0.47
▸ TP53 P04637 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MMP14 P50281 1/20 0.46
▸ HSD17B10 Q99714 3/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ ADORA2A P29274 1/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ TSHR P16473 2/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ MAPT P10636 3/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL14086603 0.89 CYP1A2 (0.49) LMNAMEN1KMT2AL3MBTL1MMP14
SCHEMBL13656876 0.87 CASP3 (0.52) LMNAMEN1KMT2AL3MBTL1MMP14
SCHEMBL11533939 0.85 MEN1 (0.64) TP53MEN1KMT2AL3MBTL1MMP14
SCHEMBL14030968 0.81 MAOA (0.57) NPC1GAAMEN1KMT2AMMP14
SCHEMBL13656877 0.80 L3MBTL1 (0.64) TP53NPC1MEN1KMT2AL3MBTL1
SCHEMBL13660406 0.80 MEN1 (0.54) LMNAHTTTP53NPC1MEN1
SCHEMBL14086566 0.80 MEN1 (0.60) TP53MEN1KMT2AL3MBTL1MMP14
SCHEMBL14030964 0.78 TERT (0.53) LMNANPC1GAAMEN1KMT2A
SCHEMBL13656878 0.77 MEN1 (0.51) LMNAMEN1KMT2AMMP14HPGD
SCHEMBL14580985 0.76 MAPT (0.67) LMNAHTTNPC1MEN1KMT2A

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
US-7435270-B2 Pigment/dye mixtures HUNTSMAN INTERNATIONAL LLC (US) 2008-10-14 — — US disclosed
US-7435270-B2 Pigment/dye mixtures HUNTSMAN INTERNATIONAL LLC (US) 2008-10-14 — — US disclosed
EP-1618154-B1 PIGMENT/DYE MIXTURES HUNTSMAN ADV MAT SWITZERLAND (CH) 2008-09-17 — — EP disclosed
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