SCHEMBL6180434

SCHEMBL6180434

Cc1ccc(S(=O)(=O)N2CCCC2c2ccsc2)cc1O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.47
LMNA P02545 2/20 0.40
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
NR3C2 P08235 1/20 0.39
GAA P10253 1/20 0.39
LOXL2 Q9Y4K0 2/20 0.38
HSD17B10 Q99714 1/20 0.38
HCRTR1 O43613 2/20 0.37
HCRTR2 O43614 2/20 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
SCHEMBL6179184 0.84 TRPA1 (0.57) TRPA1LMNAPSEN1PSEN2APH1B
SCHEMBL6178979 0.84 PSEN1 (0.57) TRPA1LMNAPSEN1PSEN2APH1B
SCHEMBL6177953 0.83 TRPA1 (0.54) TRPA1LMNAPSEN1PSEN2APH1B
SCHEMBL6177949 0.83 TRPA1 (0.54) TRPA1LMNAPSEN1PSEN2APH1B
SCHEMBL6180591 0.81 TRPA1 (0.48) TRPA1LMNAPSEN1PSEN2APH1B
SCHEMBL6178185 0.80 TRPA1 (0.53) TRPA1LMNAPSEN1PSEN2APH1B
SCHEMBL6180512 0.80 LMNA (0.65) TRPA1LMNAGAA
SCHEMBL6180550 0.79 PSEN1 (0.63) TRPA1LMNAPSEN1PSEN2APH1B
SCHEMBL6180546 0.79 PSEN1 (0.63) TRPA1LMNAPSEN1PSEN2APH1B
SCHEMBL6180330 0.79 TRPA1 (0.73) TRPA1LMNAPSEN1PSEN2APH1B

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-1165510-B1 1-ARENESULFONYL-2-ARYL-PYRROLIDINE AND PIPERIDINE DERIVATIVES FOR THE TREATMENT OF CNS DISORDERS HOFFMANN LA ROCHE (CH) 2005-09-28 EP claimed