SCHEMBL10384842

SCHEMBL10384842

CCS(=O)(=O)c1ccc(S(=O)(=O)c2cccc(S(=O)(=O)O)c2)c(N)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.45
▸ HSD17B10 Q99714 3/20 0.45
▸ TSHR P16473 2/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ GAA P10253 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ CA2 P00918 2/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ CASP6 P55212 1/20 0.40
▸ PSIP1 O75475 2/20 0.39
▸ HTR6 P50406 3/20 0.38
▸ MAPT P10636 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NAMPT P43490 5/20 0.37
▸ LMNA P02545 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
SCHEMBL10383769 0.82 CA2 (0.40) ALDH1A1HSD17B10TSHRGAAKDM4E
SCHEMBL8132585 0.82 PSIP1 (0.56) ALDH1A1HSD17B10TSHRTDP1GAA
Sulfuric Acid SCHEMBL28440581 0.81 CA2 (0.47) ALDH1A1HSD17B10TSHRGAAKDM4E
SCHEMBL9313001 0.77 HTR6 (0.65) ALDH1A1HSD17B10TSHRTDP1GAA
SCHEMBL9722737 0.77 MEN1 (0.47) ALDH1A1HSD17B10TDP1GAAKDM4E
SCHEMBL9299326 0.76 ALDH1A1 (0.51) ALDH1A1HSD17B10TSHRGAAKDM4E
SCHEMBL10389258 0.75 ALDH1A1 (0.54) ALDH1A1HSD17B10GAAKDM4EPKM
SCHEMBL10384844 0.75 ALDH1A1 (0.45) ALDH1A1HSD17B10TSHRTDP1GAA
Benzene SCHEMBL11045134 0.73 ALDH1A1 (0.60) ALDH1A1HSD17B10TSHRTDP1GAA
SCHEMBL9311752 0.73 ALDH1A1 (0.77) ALDH1A1HSD17B10TSHRTDP1GAA

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-4906740-A Monoazo dyes containing as the azo component A phenylsulfonylphenyl radical CIBA-GEIGY CORPORATION (US) 1990-03-06 — — US disclosed
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