SCHEMBL9727311

SCHEMBL9727311

O=C1CCCN1S(=O)(=O)c1ccccc1C1CCNC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GAA P10253 1/20 0.36
DRD3 P35462 1/20 0.36
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
STAT3 P40763 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL9727395 0.84 KMT2A (0.42) HTR6MEN1KMT2AGAALMNA
SCHEMBL9727446 0.83 MEN1 (0.41) HTR6MEN1KMT2AGAALMNA
SCHEMBL9732296 0.73 HTR6 (0.42) HTR6
SCHEMBL20380052 0.73 HTR6 (0.41) HTR6
SCHEMBL9727352 0.72 HTR6 (0.55) HTR6
SCHEMBL1013307 0.71 HTR6 (0.58) HTR6
SCHEMBL6797106 0.70 HTR6 (0.40) HTR6
SCHEMBL9727309 0.69 HTR6 (0.49) HTR6MEN1KMT2AGAADRD3
SCHEMBL7380549 0.66 PKM (0.62) HTR6MEN1KMT2AGAALMNA
SCHEMBL7674989 0.66 MGLL (0.47) HTR6LMNATSHRSTAT3RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5164514-A Antispasmodics ROUSSEL UCLAF (FR) 1992-11-17 US disclosed
US-5081130-A Antispasmodic agents ROUSSEL UCLAF (FR) 1992-01-14 US disclosed
US-4990531-A Antispasmodic agents ROUSSEL UCLAF (FR) 1991-02-05 US disclosed
EP-0335758-A2 Derivatives of 1-arylsulfonyl-2-pyrolidinone, process for their preparation, their use as medicaments and compositions containing them ROUSSEL-UCLAF (FR) 1989-10-04 EP disclosed