SCHEMBL9660625

SCHEMBL9660625

CCN(CC)c1ccc(S(=O)(=O)N2CCC(O)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.50
▸ HRH3 Q9Y5N1 1/20 0.50
▸ HSD11B1 P28845 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ AKR1C3 P42330 2/20 0.45
▸ TDO2 P48775 2/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ TLR8 Q9NR97 1/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ NR2F2 P24468 1/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL12188944 0.82 ALDH1A1 (0.64) KCNH2HRH3HSD11B1TP53AKR1C3
SCHEMBL4516709 0.80 PKM (0.57) KCNH2HRH3HSD11B1ALDH1A1RAB9A
SCHEMBL3235054 0.80 PKM (0.57) KCNH2HRH3HSD11B1ALDH1A1RAB9A
SCHEMBL3235046 0.80 PKM (0.57) KCNH2HRH3HSD11B1ALDH1A1RAB9A
SCHEMBL12730547 0.78 KMT2A (0.64) ALDH1A1MEN1KMT2A
SCHEMBL846953 0.77 AKR1C3 (0.49) KCNH2HRH3HSD11B1MAPTAKR1C3
SCHEMBL19563449 0.77 TDO2 (0.52) KCNH2HRH3HSD11B1MAPTAKR1C3
SCHEMBL5254329 0.77 LMNA (0.62) TP53MAPTALDH1A1MEN1KMT2A
SCHEMBL5915284 0.77 LMNA (0.62) TP53MAPTALDH1A1MEN1KMT2A
SCHEMBL21772288 0.77 AKR1C3 (0.54) KCNH2HRH3HSD11B1AKR1C3TDO2

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-0490765-A2 1-Arylsulfonyl-2-pyrrolidone-derivatives, process for their preparation, new in termediates, use for medicaments and drugs containing them ROUSSEL-UCLAF (FR) 1992-06-17 — — EP disclosed
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