SCHEMBL9761992

SCHEMBL9761992

Cc1ccc(Cl)cc1NCCS(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.50
POLB P06746 2/20 0.50
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
TSHR P16473 2/20 0.43
MAPT P10636 4/20 0.43
HTT P42858 2/20 0.43
THRB P10828 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL9762899 0.91 GAA (0.48) GAAPOLBALDH1A1LMNATSHR
SCHEMBL10795123 0.84 MEN1 (0.49) GAAPOLBALDH1A1MAPTHTT
SCHEMBL10798749 0.81 MEN1 (0.55) GAAPOLBALDH1A1LMNASMN1; SMN2
SCHEMBL10795158 0.77 MAPT (0.62) GAAPOLBALDH1A1MAPTHTT
SCHEMBL11460570 0.77 ALDH1A1 (0.48) POLBALDH1A1TSHRMAPTSMN1; SMN2
SCHEMBL9762950 0.77 GAA (0.43) GAAPOLBALDH1A1LMNATSHR
SCHEMBL28892333 0.76 HDAC8 (0.46) GAAPOLBLMNAMAPTHTT
SCHEMBL22791495 0.76 GAA (0.58) GAAPOLBALDH1A1LMNATSHR
SCHEMBL7657031 0.76 GAA (0.50) GAAPOLBALDH1A1LMNATSHR
SCHEMBL10126545 0.75 GUCY1A1 (0.59) GAAPOLBALDH1A1LMNAMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5003052-A Monoazo fiber reactive dye for cellulose, polyamides, wool, silk, polyurethanes and leather CIBA-GEIGY CORPORATION (US) 1991-03-26 US disclosed
US-4652634-A Water-soluble monoazo compounds containing a N-(sulfoalkyl)-aniline coupling component and a fiber-reactive group of the vinylsulfonyl series in the phenyl or benzothiazole diazo component, suitable as fiber-reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-24 US disclosed
US-4430259-A Water-soluble disazo compounds suitable as fiber-reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1984-02-07 US disclosed