SCHEMBL10404990

SCHEMBL10404990

CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 10/20 0.50
▸ KMT2A Q03164 1/20 0.47
▸ LMNA P02545 3/20 0.47
▸ ACE P12821 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.43
▸ F10 P00742 1/20 0.43
▸ RECQL P46063 1/20 0.42
▸ NPSR1 Q6W5P4 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
SCHEMBL10404429 0.88 FKBP1A (0.50) FKBP1AACEF10
SCHEMBL10404568 0.87 ACE (0.53) FKBP1AACEF10
SCHEMBL10403953 0.87 FKBP1A (0.53) FKBP1AACEALDH1A1F10
SCHEMBL10404572 0.87 KMT2A (0.49) KMT2ALMNAACEALDH1A1F10
SCHEMBL10404430 0.87 F10 (0.49) FKBP1AACEF10
SCHEMBL15251676 0.86 FKBP1A (0.52) FKBP1ALMNAACE
SCHEMBL15251677 0.86 FKBP1A (0.52) FKBP1ALMNAACE
SCHEMBL15251894 0.84 FKBP1A (0.56) FKBP1AACEF10
SCHEMBL10403271 0.83 FKBP1A (0.54) FKBP1AACEALDH1A1
SCHEMBL10403978 0.82 FKBP1A (0.48) FKBP1AACE

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-4971993-A HYPOTENSIVE DIPEPTIDES DERIVATIVES AJINOMOTO CO., INC. (JP) 1990-11-20 — — US disclosed
EP-0190852-A2 Dipeptide derivatives and antihypertensive drugs containing them AJINOMOTO CO., INC. (JP) 1986-08-13 — — EP disclosed
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