SCHEMBL6014533

SCHEMBL6014533

CS(=O)(=O)C(N)(c1ccccc1)S(C)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 2/20 0.46
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA5A P35218 2/20 0.45
CA9 Q16790 2/20 0.45
NR3C2 P08235 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
KIF11 P52732 2/20 0.39
TAAR1 Q96RJ0 1/20 0.38
KEAP1 Q14145 1/20 0.38
CA12 O43570 1/20 0.37
CA3 P07451 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA7 P43166 1/20 0.37
PLA2G7 Q13093 1/20 0.37
CA13 Q8N1Q1 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
SCHEMBL5140207 0.79 NR3C2 (0.44) KCNN4CA1CA2CA5ACA9
SCHEMBL27899372 0.73 NR3C2 (0.42) KCNN4CA1CA2CA5ACA9
SCHEMBL12161965 0.73 NR3C2 (0.47) KCNN4CA1CA2CA5ACA9
SCHEMBL27348750 0.73 NR3C2 (0.47) KCNN4CA1CA2CA5ACA9
Hydrochloric Acid SCHEMBL27379205 0.73 CYP1A2 (0.43) KCNN4CA1CA2CA5ACA9
SCHEMBL28752261 0.73 MAPT (0.52) KCNN4CA1CA2CA5ACA9
SCHEMBL6543485 0.71 NR3C2 (0.41) KCNN4CA1CA2CA5ACA9
SCHEMBL7126033 0.71 CA1 (0.61) KCNN4CA1CA2CA5ACA9
SCHEMBL27704938 0.70 CA2 (0.60) KCNN4CA1CA2CA5ACA9
Sulfuric Acid SCHEMBL29215267 0.70 MAPT (0.48) KCNN4CA1CA2CA5ACA9

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-3280751-A1 POLYOL PREMIX COMPOSITION FOR RIGID POLYURETHANE FOAMS Covestro Deutschland AG (DE) 2018-02-14 EP disclosed
WO-2016162362-A1 POLYOL PREMIX COMPOSITION FOR RIGID POLYURETHANE FOAMS COVESTRO DEUTSCHLAND AG (DE) 2016-10-13 WO disclosed
EP-1671183-A2 PHOTOCURABLE COMPOSITIONS FOR ARTICLES HAVING STABLE TENSILE PROPERTIES Huntsman Advanced Materials (Switzerland) GmbH (CH) 2006-06-21 EP disclosed
WO-2005045522-A2 PHOTOCURABLE COMPOSITIONS FOR ARTICLES HAVING STABLE TENSILE PROPERTIES HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2005-05-19 WO disclosed