SCHEMBL9621784

SCHEMBL9621784

CCCCCOc1ccc(S(=O)(=O)N2CCCC2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.61
MAPK1 P28482 2/20 0.61
RECQL P46063 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
LTA4H P09960 1/20 0.48
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TP53 P04637 3/20 0.46
HTT P42858 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
HTR2A P28223 1/20 0.44

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
SCHEMBL9727670 0.78 TP53 (0.41) TSHRMAPK1RECQLL3MBTL1GAA
SCHEMBL6982332 0.77 L3MBTL1 (0.74) TSHRMAPK1RECQLL3MBTL1CA12
SCHEMBL9727409 0.77 TP53 (0.48) GAATP53HTTALDH1A1MMP2
SCHEMBL20042185 0.76 MMP2 (0.65) TSHRL3MBTL1TP53HTTSMN1; SMN2
SCHEMBL7383735 0.75 MMP2 (0.64) RECQLL3MBTL1CA1CA2GAA
SCHEMBL13527221 0.75 TSHR (0.66) TSHRMAPK1RECQLL3MBTL1CA12
SCHEMBL9799573 0.75 TP53 (0.46) L3MBTL1GAATP53SMN1; SMN2MMP2
SCHEMBL22251609 0.75 PARL (0.51) TSHRMAPK1RECQLL3MBTL1CA12
SCHEMBL9658919 0.74 GAA (0.44) L3MBTL1GAATP53SMN1; SMN2ALDH1A1
SCHEMBL6741187 0.74 TSHR (0.64) TSHRMAPK1RECQLL3MBTL1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300850-B1 1-ARYLSULFONYL-1,5-DIHYDRO 2H-PYRROL-2-ONE DERIVATIVES, INTERMEDIATES AND PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICINES AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1992-08-26 EP disclosed
EP-0298818-B1 1-BENZENESULFONYL 2-OXO 5-ALKYLTHIO PYRROLIDINES, PROCESS FOR THEIR PREPARATION, THEIR INTERMEDIARIES AND THEIR USE AS MEDICINES ROUSSEL-UCLAF (FR) 1992-08-26 EP disclosed
EP-0239500-B1 1-STYRENE-SULFONYL-2-OXO-5-HYDROXY-PYRROLIDINE DERIVATIVES, THEIR INTERMEDIATES, PROCESS FOR THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND THEIR USE AS MEDICINES ROUSSEL-UCLAF (FR) 1992-01-22 EP disclosed