SCHEMBL11533939

SCHEMBL11533939

O=C(Nc1ccc(Sc2ccccc2)c2c1C(=O)c1ccccc1C2=O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.64
▸ KMT2A Q03164 2/20 0.64
▸ MMP14 P50281 1/20 0.64
▸ MAPT P10636 3/20 0.59
▸ TDP1 Q9NUW8 2/20 0.59
▸ CYP1A2 P05177 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ ALDH1A1 P00352 3/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ GLA P06280 1/20 0.50
▸ CASP3 P42574 1/20 0.49
▸ POLB P06746 2/20 0.48
▸ CCR6 P51684 1/20 0.48
▸ BLM P54132 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ HPGD P15428 2/20 0.47
▸ ADORA2A P29274 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ NSD2 O96028 1/20 0.46
▸ MAPK1 P28482 1/20 0.46

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
SCHEMBL13656877 0.92 L3MBTL1 (0.64) MEN1KMT2AMMP14MAPTTDP1
SCHEMBL13660406 0.92 MEN1 (0.54) MEN1KMT2AMMP14MAPTTDP1
SCHEMBL13656878 0.89 MEN1 (0.51) MEN1KMT2AMMP14MAPTTDP1
SCHEMBL14086566 0.86 MEN1 (0.60) MEN1KMT2AMMP14MAPTTDP1
SCHEMBL14086603 0.86 CYP1A2 (0.49) MEN1KMT2AMMP14MAPTTDP1
SCHEMBL30544874 0.86 MEN1 (0.82) MEN1KMT2AMMP14MAPTTDP1
SCHEMBL6419867 0.86 MEN1 (0.82) MEN1KMT2AMMP14MAPTTDP1
SCHEMBL11535756 0.86 MAPT (0.66) MEN1KMT2AMMP14MAPTTDP1
SCHEMBL14030968 0.85 MAOA (0.57) MEN1KMT2AMMP14MAPTALDH1A1
SCHEMBL14030998 0.85 LMNA (0.47) MEN1KMT2AMMP14MAPTTDP1

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 4 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
US-4176113-A ANTRAQUINONE DYES CIBA-GEIGY CORPORATION (US) 1979-11-27 — — US disclosed
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