SCHEMBL7205052

SCHEMBL7205052

COc1ccc(S(=O)(=O)N2CCCCC2)cc1OC

nearest known ligand 0.88

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 1/20 0.88
TSHR P16473 4/20 0.78
MCOLN3 Q8TDD5 2/20 0.78
ALDH1A1 P00352 3/20 0.73
LMNA P02545 3/20 0.68
THRB P10828 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
USP2 O75604 1/20 0.64
GLA P06280 1/20 0.64
MAPK1 P28482 1/20 0.64
HSD17B10 Q99714 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
HTT P42858 1/20 0.64

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
SCHEMBL7209087 0.98 GPBAR1 (0.91) GPBAR1TSHRMCOLN3ALDH1A1LMNA
SCHEMBL6367892 0.95 GPBAR1 (0.97) GPBAR1TSHRMCOLN3ALDH1A1LMNA
Sb-756050 SCHEMBL4174350 0.94 GPBAR1 (1.00) GPBAR1TSHRMCOLN3ALDH1A1LMNA
SCHEMBL3830421 0.92 GPBAR1 (0.90) GPBAR1TSHRMCOLN3ALDH1A1LMNA
SCHEMBL4184681 0.92 GPBAR1 (0.90) GPBAR1TSHRMCOLN3ALDH1A1LMNA
SCHEMBL24263764 0.86 MCOLN3 (0.70) GPBAR1TSHRMCOLN3ALDH1A1LMNA
SCHEMBL6118073 0.86 MCOLN3 (0.70) GPBAR1TSHRMCOLN3ALDH1A1LMNA
SCHEMBL22116077 0.86 MCOLN3 (0.70) GPBAR1TSHRMCOLN3ALDH1A1LMNA
SCHEMBL8305327 0.86 LMNA (0.91) GPBAR1TSHRMCOLN3ALDH1A1LMNA
SCHEMBL4193765 0.86 GPBAR1 (0.84) GPBAR1TSHRMCOLN3ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1045690-B1 BENZENESULFONAMIDE INHIBITORS OF PDE-IV AND THEIR THERAPEUTIC USE WARNER LAMBERT CO (US) 2003-04-23 EP claimed
US-6162830-A Benzenesulfonamide inhibitors of PDE-IV and their therapeutic use WARNER-LAMBERT COMPANY (US) 2000-12-19 US claimed
EP-1045690-A1 BENZENESULFONAMIDE INHIBITORS OF PDE-IV AND THEIR THERAPEUTIC USE WARNER-LAMBERT COMPANY (US) 2000-10-25 EP claimed
WO-1999026616-A1 BENZENESULFONAMIDE INHIBITORS OF PDE-IV AND THEIR THERAPEUTIC USE WARNER-LAMBERT COMPANY (US) 1999-06-03 WO claimed
EP-1045690-B1 BENZENESULFONAMIDE INHIBITORS OF PDE-IV AND THEIR THERAPEUTIC USE WARNER LAMBERT CO (US) 2003-04-23 EP disclosed
US-6162830-A Benzenesulfonamide inhibitors of PDE-IV and their therapeutic use WARNER-LAMBERT COMPANY (US) 2000-12-19 US disclosed