SCHEMBL14625743

SCHEMBL14625743

Cc1ccc(N=Nc2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(NC(N)=O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ ENPP2 Q13822 4/20 0.41
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ P2RX3 P56373 2/20 0.40
▸ NT5E P21589 1/20 0.38
▸ MPL P40238 1/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ THRB P10828 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ P2RX2 Q9UBL9 1/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL11424803 0.88 ENPP2 (0.43) ALDH1A1ENPP2MEN1KMT2AMAPT
SCHEMBL9626740 0.87 ENPP2 (0.47) ALDH1A1HIF1AENPP2MEN1KMT2A
SCHEMBL9626874 0.87 ENPP2 (0.47) ALDH1A1HIF1AENPP2MEN1KMT2A
SCHEMBL10351010 0.86 ENPP2 (0.41) ALDH1A1HIF1AENPP2MEN1KMT2A
SCHEMBL9809307 0.86 ENPP2 (0.41) ALDH1A1HIF1AENPP2MEN1KMT2A
SCHEMBL9809298 0.86 ENPP2 (0.41) ALDH1A1HIF1AENPP2MEN1KMT2A
SCHEMBL10351007 0.86 ENPP2 (0.41) ALDH1A1HIF1AENPP2MEN1KMT2A
Ammonia Solution, Strong SCHEMBL10351170 0.84 SENP3 (0.40) ALDH1A1HIF1AENPP2MEN1KMT2A
SCHEMBL13298506 0.80 PTPN11 (0.38) ALDH1A1HIF1AENPP2MEN1KMT2A
SCHEMBL13151829 0.80 CHAT (0.45) ENPP2MEN1KMT2AP2RX3NT5E

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
WO-2007006653-A2 REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (DE) 2007-01-18 — — WO disclosed
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