SCHEMBL7085134

SCHEMBL7085134

CC(C)N(C1CCCCC1)S(=O)(=O)NC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP2C19 P33261 1/20 0.37
TSHR P16473 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
SCHEMBL3220299 0.79 KMT2A (0.45) POLBMEN1KMT2AALDH1A1TSHR
SCHEMBL7570121 0.72
SCHEMBL6205344 0.71 ADH1A (0.47) POLBADH1BADH1CADH1AMEN1
SCHEMBL24429228 0.71 ADH1A (0.47) POLBADH1BADH1CADH1AMEN1
SCHEMBL10639964 0.68 ADH1A (0.44) POLBADH1BADH1CADH1AMEN1
SCHEMBL7511009 0.68 MEN1 (0.38) POLBADH1BADH1CADH1AMEN1
SCHEMBL24391652 0.67 ADH1A (0.42) POLBADH1BADH1CADH1AMEN1
SCHEMBL24568892 0.66 ADH1C (0.40) POLBADH1BADH1CADH1AMEN1
SCHEMBL7085240 0.66 CYP2D6 (0.32) CYP2C19
SCHEMBL24391650 0.65 ADH1B (0.39) ADH1BADH1CADH1A

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
EP-0592439-B1 AMINOSULFONYL CARBAMATES WARNER LAMBERT CO (US) 2003-07-30 EP claimed