SCHEMBL10583792

SCHEMBL10583792

Cc1ccc(S(=O)(=O)c2cc(NC(=O)NC(C)(C)C)ccc2N)cc1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 1/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ IDH1 O75874 8/20 0.41
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KCNJ6 P48051 4/20 0.40
▸ KCNJ3 P48549 4/20 0.40

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
SCHEMBL10581643 0.89 KMT2A (0.46) ENPP2CA2CA12CA1CA9
SCHEMBL10581147 0.87 KCNJ6 (0.56) CA2CA12CA1CA9IDH1
SCHEMBL10580263 0.86 MAPT (0.50) ENPP2CA2CA12CA1CA9
SCHEMBL10582238 0.86 ENPP2 (0.50) ENPP2CA2CA12CA1CA9
SCHEMBL10580086 0.86 GHSR (0.42) ENPP2CA2CA12CA1CA9
SCHEMBL11648080 0.85 ABCC9 (0.41) ENPP2CA2CA12CA1CA9
SCHEMBL10582790 0.84 CTDSP1 (0.40) ENPP2CA2CA12CA1CA9
SCHEMBL10579830 0.83 ATM (0.49) CA2CA12CA1CA9NPC1
SCHEMBL10578829 0.83 CA12 (0.47) CA2CA12CA1CA9NPC1
SCHEMBL13071589 0.82 IDH1 (0.53) ENPP2CA2CA12CA1CA9

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
US-4843151-A RED/YELLOW DYES FOR NATURAL AND SYNTHETIC POLYAMIDES USING AN AQUEOUS BATH; COLORFASTNESS CIBA-GEIGY CORPORATION (US) 1989-06-27 — — US disclosed
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