SCHEMBL11627596

SCHEMBL11627596

CC(C)OC(=O)NS(=O)(=O)c1ccc(CCNC(=O)c2cccc(Cl)c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FLT1 P17948 1/20 0.52
▸ FLT4 P35916 1/20 0.52
▸ KDR P35968 1/20 0.52
▸ KDM1A O60341 2/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ PPARA Q07869 1/20 0.48
▸ NLRP3 Q96P20 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MAOA P21397 1/20 0.46

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
SCHEMBL11624474 0.88 KDM1A (0.49) KDM1ACA1CA2ALDH1A1LMNA
SCHEMBL11625380 0.87 MEN1 (0.55) CA1CA2PPARAALDH1A1LMNA
SCHEMBL11626120 0.87 CA1 (0.57) KDM1ACA1CA2ALDH1A1SMN1; SMN2
SCHEMBL11623182 0.86 ALDH1A1 (0.52) KDM1AALDH1A1LMNAMAOA
SCHEMBL11627098 0.84 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2
SCHEMBL11626679 0.83 FLT1 (0.51) FLT1FLT4KDRKDM1ACA1
SCHEMBL11630984 0.82 NLRP3 (0.62) FLT1FLT4KDRNLRP3ALDH1A1
SCHEMBL11624745 0.82 NLRP3 (0.74) NLRP3ALDH1A1LMNA
SCHEMBL11629012 0.81 MAPT (0.61) CA1CA2ALDH1A1LMNASMN1; SMN2
SCHEMBL11624959 0.80 NLRP3 (0.60) NLRP3ALDH1A1LMNA

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-4066639-A BENZENE-SULFONYL SEMICARBAZIDES AND PROCESS FOR PREPARING THEM HOECHST AKTIENGESELLSCHAFT (DT) 1978-01-03 — — US disclosed
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