SCHEMBL16480428

SCHEMBL16480428

CC1CCCN1S(=O)(=O)c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.68
PSEN2 P49810 1/20 0.68
APH1B Q8WW43 1/20 0.68
NCSTN Q92542 1/20 0.68
APH1A Q96BI3 1/20 0.68
PSENEN Q9NZ42 1/20 0.68
AKR1C3 P42330 8/20 0.58
LMNA P02545 2/20 0.58
KMT2A Q03164 1/20 0.56
HSD11B1 P28845 1/20 0.56
HCRTR1 O43613 1/20 0.52
HCRTR2 O43614 1/20 0.52
ALDH1A1 P00352 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ACHE P22303 1/20 0.49

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
SCHEMBL6184031 1.00 PSEN1 (0.68) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL15013070 0.87 PSEN1 (0.68) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12169284 0.87 PSEN1 (0.68) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL16802354 0.85 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18065225 0.85 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12203729 0.85 PSEN1 (0.91) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18065224 0.85 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10067927 0.85 TRPA1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4002131 0.85 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL19563392 0.85 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A

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
US-8629157-B2 Pyrrolidine compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-14 US disclosed