SCHEMBL7385524

SCHEMBL7385524

O=C(O)C(Cc1ccccc1)NS(=O)(=O)N1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ KMT2A Q03164 1/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.61
▸ REN P00797 13/20 0.54
▸ MMP2 P08253 4/20 0.51
▸ MMP9 P14780 3/20 0.51
▸ ADAMTS4 O75173 1/20 0.51
▸ CTSD P07339 5/20 0.49
▸ PGA5 P0DJD9 5/20 0.49
▸ CTSE P14091 5/20 0.49
▸ PGC P20142 2/20 0.49
▸ MAPT P10636 1/20 0.49

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
SCHEMBL7317104 1.00 MEN1 (0.61) MEN1ALDH1A1KMT2ASMN1; SMN2REN
SCHEMBL8683934 0.86 ALDH1A1 (0.58) MEN1ALDH1A1KMT2AMMP2MMP9
SCHEMBL7332179 0.84 MMP2 (0.51) MEN1ALDH1A1KMT2AMMP2MMP9
SCHEMBL7332174 0.84 MMP2 (0.51) MEN1ALDH1A1KMT2AMMP2MMP9
SCHEMBL7354503 0.83 MEN1 (0.48) MEN1ALDH1A1KMT2ASMN1; SMN2REN
SCHEMBL7299611 0.82 ALDH1A1 (0.54) MEN1ALDH1A1KMT2ASMN1; SMN2MMP2
SCHEMBL7346803 0.82 REN (0.64) MEN1ALDH1A1KMT2ASMN1; SMN2REN
SCHEMBL9437597 0.82 MEN1 (0.49) MEN1ALDH1A1KMT2ASMN1; SMN2REN
SCHEMBL9437603 0.81 MEN1 (0.46) MEN1ALDH1A1KMT2ASMN1; SMN2REN
SCHEMBL4673538 0.81 MMP2 (0.55) MEN1ALDH1A1KMT2AMMP2MMP9

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-5272268-A Dipeptide derivatives SHIONOGI & CO., LTD. (JP) 1993-12-21 — — US disclosed
US-5223615-A Hypotensive agents SHIONOGI & CO., LTD. (JP) 1993-06-29 — — US disclosed
US-5194608-A Hypotensive agents; inhibits renin-angiotensin system SHIONOGI & CO., LTD. (JP) 1993-03-16 — — US disclosed
EP-0468641-A2 Renin inhibiting dipeptide derivatives, their preparation and pharmaceutical preparations containing them SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1992-01-29 — — EP disclosed
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