SCHEMBL5669707

SCHEMBL5669707

CC1CCC(C(C)C)C(c2ccccc2S(N)(=O)=O)C1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.44
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
HPGD P15428 1/20 0.41
TRPM8 Q7Z2W7 3/20 0.39
OPRM1 P35372 1/20 0.38
EPHX1 P07099 1/20 0.38
P2RX4 Q99571 1/20 0.37
TRPV1 Q8NER1 2/20 0.37
NFE2L2 Q16236 1/20 0.37
TRPA1 O75762 2/20 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
SCHEMBL6367720 0.84 CA1 (0.41) KCNA5ALDH1A1LMNACA1CA2
SCHEMBL10700915 0.83 KCNA5 (0.50) KCNA5ALDH1A1LMNACA1CA2
SCHEMBL5824341 0.80 OPRM1 (0.47) KCNA5ALDH1A1LMNAHPGDTRPM8
SCHEMBL8498802 0.78 KCNA5 (0.46) KCNA5ALDH1A1LMNACA1CA2
SCHEMBL8336802 0.77 KCNA5 (0.44) KCNA5ALDH1A1LMNACA1CA2
SCHEMBL27812850 0.75 ALDH1A1 (0.49) KCNA5ALDH1A1LMNAHPGDTRPM8
SCHEMBL1872252 0.75 ALDH1A1 (0.49) KCNA5ALDH1A1LMNACA1CA2
SCHEMBL2392586 0.75 OPRM1 (0.45) KCNA5ALDH1A1LMNAHPGDTRPM8
SCHEMBL7540738 0.74 KDM1A (0.49) KCNA5ALDH1A1LMNAHPGDTRPM8
SCHEMBL17847282 0.74 HTR2C (0.46) KCNA5ALDH1A1LMNACA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1723102-A2 N-SUBSTITUTED BENZENE SULFONAMIDES Elan Pharmaceuticals, Inc. (US) 2006-11-22 EP disclosed
WO-2005090296-A2 N-SUBSTITUTED BENZENE SULFONAMIDES ELAN PHARMACEUTICALS, INC. (US) 2005-09-29 WO disclosed