SCHEMBL7204377

SCHEMBL7204377

C#CCN(C)S(=O)(=O)c1ccc(OCC)c(OCC)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.47
ALDH1A1 P00352 4/20 0.41
GAA P10253 2/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.39
PKM P14618 1/20 0.38
KMT2A Q03164 2/20 0.37
OGT O15294 1/20 0.37
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL7207494 0.83 TSHR (0.51) HTTALDH1A1GAATSHRKMT2A
SCHEMBL7209464 0.81 HTT (0.55) HTTALDH1A1GAATSHRPKM
SCHEMBL7208549 0.78 HTT (0.47) HTTALDH1A1GAAHPGDTSHR
SCHEMBL14601548 0.76 HTT (0.75) HTTALDH1A1TSHRMAPTPOLB
SCHEMBL29597888 0.72 GLA (0.53) GAAMAPTPOLBLMNASMN1; SMN2
SCHEMBL11109645 0.72 MAOB (0.38) ALDH1A1GAAHPGDTSHRKMT2A
SCHEMBL22590675 0.71 PYCR1 (0.49) ALDH1A1GAAHPGDTSHRKMT2A
SCHEMBL31592654 0.71 SIGMAR1 (0.49) HTTALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL8193976 0.71 CA2 (0.59) HTTALDH1A1GAATSHRPKM
SCHEMBL2564265 0.71 ALDH1A1 (0.47) HTTALDH1A1GAAHPGDTSHR

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