SCHEMBL9670975

SCHEMBL9670975

C=CCCC(=O)NS(=O)(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.50
ERBB2 P04626 5/20 0.50
EPHX2 P34913 2/20 0.49
FAAH O00519 1/20 0.45
P4HTM Q9NXG6 1/20 0.45
TBXA2R P21731 1/20 0.44
KDM4E B2RXH2 3/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
HPGD P15428 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 1/20 0.43

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
SCHEMBL5663340 0.85 EGFR (0.51) EGFRERBB2EPHX2FAAHP4HTM
SCHEMBL10993215 0.84 EGFR (0.60) EGFRERBB2EPHX2P4HTMTBXA2R
SCHEMBL4557833 0.83 EGFR (0.53) EGFRERBB2P4HTMKDM4EPTGS1
SCHEMBL29788449 0.83 EPHX2 (0.54) EGFRERBB2EPHX2FAAHP4HTM
SCHEMBL7825039 0.81 EGFR (0.54) EGFRERBB2EPHX2P4HTMKDM4E
SCHEMBL1161379 0.80 EGFR (0.55) EGFRERBB2P4HTMKDM4EPTGS1
SCHEMBL16353991 0.80 EGFR (0.55) EGFRERBB2P4HTMTBXA2RKDM4E
SCHEMBL2810873 0.78 EPHX2 (0.55) EGFRERBB2EPHX2P4HTMKDM4E
SCHEMBL7315907 0.78 EGFR (0.57) EGFRERBB2P4HTMKDM4EPTGS1
SCHEMBL398043 0.77 TBXA2R (0.42) TBXA2RCA1CA2MMP1MMP2

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-0229566-B1 1-BENZENE SULFONYL 2-OXO-5-ALKOXY PYRROLIDINES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICINE AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1992-05-06 EP disclosed
US-4829079-A AMNESIA ROUSSEL UCLAF (FR) 1989-05-09 US disclosed
EP-0229566-A2 1-Benzene sulfonyl 2-oxo-5-alkoxy pyrrolidines, process for their preparation, their use as medicine and compositions containing them ROUSSEL-UCLAF (FR) 1987-07-22 EP disclosed