SCHEMBL9556385

SCHEMBL9556385

N[C@@H](Cc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)NC(CC(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.58
▸ KMT2A Q03164 5/20 0.58
▸ MEN1 O00255 4/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ GAA P10253 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ POLB P06746 1/20 0.44
▸ HTT P42858 2/20 0.44
▸ MAPT P10636 1/20 0.43
▸ ALOX12 P18054 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
SCHEMBL7354500 0.83 LMNA (0.60) ALDH1A1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL7319330 0.82 ALDH1A1 (0.53) ALDH1A1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL7329311 0.81 ALDH1A1 (0.53) ALDH1A1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL7323392 0.80 MEN1 (0.52) ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9822661 0.75 SLC7A5 (0.59) —
SCHEMBL2878352 0.75 MME (0.66) GAAMAPT
SCHEMBL29498365 0.75 MME (0.66) GAAMAPT
SCHEMBL4778524 0.75 MME (0.66) GAAMAPT
SCHEMBL17903209 0.74 CA2 (0.50) —
SCHEMBL30564982 0.73 ENPEP (0.58) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5198426-A RENIN INHIBITORS CONTAINING C-TERMINAL DIHYDROXY AMIDES WARNER-LAMBERT COMPANY (US) 1993-03-30 — — US disclosed
EP-0380805-A1 Renin inhibitors containing C-terminal dihydroxy amides WARNER-LAMBERT COMPANY (US) 1990-08-08 — — EP disclosed
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