SCHEMBL11315411

SCHEMBL11315411

Nc1[c]ccc2cc(S(=O)(=O)O)ccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 4/20 0.54
ALDH1A1 P00352 4/20 0.54
HSD17B10 Q99714 4/20 0.54
CYP2C9 P11712 3/20 0.54
CYP2C19 P33261 2/20 0.54
NT5E P21589 4/20 0.47
NSD2 O96028 2/20 0.47
DUSP3 P51452 1/20 0.47
PTPN5 P54829 1/20 0.47
PTPN11 Q06124 1/20 0.47
TSHR P16473 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 2/20 0.38
PRMT1 Q99873 1/20 0.38
ENPP2 Q13822 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.37
SNCA P37840 2/20 0.37
PTPRA P18433 1/20 0.36
PTPRB P23467 1/20 0.36
HIF1A Q16665 1/20 0.36

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
SCHEMBL6631398 0.81 ALDH1A1 (0.47) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL4904953 0.81 ALDH1A1 (0.47) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL7068249 0.78 NT5E (0.57) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL11491211 0.78 SUMO2 (0.48) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL11352976 0.75 CASP6 (0.50) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL7065098 0.75 ALDH1A1 (0.49) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL157169 0.72 ALDH1A1 (0.62) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL6051291 0.72 ALDH1A1 (0.67) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL4115148 0.72 ALDH1A1 (0.62) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL31149848 0.72 ALDH1A1 (0.62) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0006135-B1 ADDITIVE FOR INORGANIC BINDERS, BUILDING MATERIAL AND PROCESS FOR ITS PREPARATION CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1981-09-16 EP claimed
US-4272430-A WATER SOLUBLE SALT OF MIXED RESIN OF UREA, MELAMINE AND AN AROMATIC AMINOSULFONIC ACID WITH FORMALDEHYDE CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1981-06-09 US claimed
EP-0006135-A1 Additive for inorganic binders, building material and process for its preparation CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1980-01-09 EP claimed
EP-0006135-B1 ADDITIVE FOR INORGANIC BINDERS, BUILDING MATERIAL AND PROCESS FOR ITS PREPARATION CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1981-09-16 EP disclosed