SCHEMBL6764218

SCHEMBL6764218

CC(Cl)S(=O)(=O)c1c[c]c(Cl)cc1

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL1045428 0.76 ENPP2 (0.41) ALDH1A1CYP3A4MAPK1
SCHEMBL193882 0.73 GAA (0.44) ALDH1A1CYP3A4MAPK1CA1CA2
SCHEMBL9450866 0.73 PSEN1 (0.30) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18660576 0.73 PSEN1 (0.30) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1827674 0.72 CA2 (0.52) ALDH1A1CA1CA2
SCHEMBL5503556 0.72 LMNA (0.43) SMN1; SMN2ALDH1A1CYP3A4MAPK1CA1
SCHEMBL6319001 0.72 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1CA1CA2
SCHEMBL1045254 0.72 CA1 (0.57) SMN1; SMN2ALDH1A1MAPK1CA1CA2
SCHEMBL27993425 0.70 ALDH1A1 (0.30) SMN1; SMN2ALDH1A1
SCHEMBL3278474 0.70 GAA (0.59) SMN1; SMN2ALDH1A1CYP3A4MAPK1CA1

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-20040139567-A1 Dye mixtures of fiber-reactive azodyes and use thereof DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2004-07-22 US disclosed