SCHEMBL14030963

SCHEMBL14030963

O=C(Nc1ccc(Sc2ccccc2Cl)c2c1C(=O)c1ccccc1C2=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ MMP14 P50281 1/20 0.58
▸ CYP1A2 P05177 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ HSP90AA1 P07900 4/20 0.49
▸ HSP90AB1 P08238 4/20 0.49
▸ CASP3 P42574 1/20 0.45
▸ MAPT P10636 3/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ POLB P06746 2/20 0.45
▸ CCR6 P51684 2/20 0.45
▸ BLM P54132 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ TP53 P04637 2/20 0.44
▸ MDM4 O15151 1/20 0.44
▸ MDM2 Q00987 1/20 0.44
▸ APAF1 O14727 2/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ HTT P42858 2/20 0.43

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
SCHEMBL14086566 0.87 MEN1 (0.60) MEN1KMT2AMMP14CYP1A2TSHR
SCHEMBL14086380 0.86 MEN1 (0.69) MEN1KMT2AMMP14CYP1A2TSHR
SCHEMBL11533939 0.85 MEN1 (0.64) MEN1KMT2AMMP14CYP1A2TSHR
SCHEMBL13660406 0.82 MEN1 (0.54) MEN1KMT2AMMP14CYP1A2TSHR
SCHEMBL30546483 0.82 MEN1 (0.70) MEN1KMT2AMMP14CYP1A2TSHR
SCHEMBL7034212 0.82 MEN1 (0.70) MEN1KMT2AMMP14CYP1A2TSHR
SCHEMBL30544874 0.82 MEN1 (0.82) MEN1KMT2AMMP14CYP1A2TSHR
SCHEMBL6419867 0.82 MEN1 (0.82) MEN1KMT2AMMP14CYP1A2TSHR
SCHEMBL11536077 0.80 CYP1A2 (0.64) MEN1KMT2AMMP14CYP1A2TSHR
SCHEMBL13656876 0.80 CASP3 (0.52) MEN1KMT2AMMP14CYP1A2TSHR

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
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
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