SCHEMBL11059164

SCHEMBL11059164

CCC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 7/20 0.59
▸ MME P08473 5/20 0.54
▸ ACE P12821 5/20 0.54
▸ CPA1 P15085 5/20 0.54
▸ ACE2 Q9BYF1 5/20 0.54
▸ PSMB5 P28074 2/20 0.49
▸ REN P00797 1/20 0.48
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ ANPEP P15144 1/20 0.47

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
SCHEMBL11059196 1.00 CTSD (0.59) CTSDMMEACECPA1ACE2
SCHEMBL30139031 0.91 ACE (0.56) CTSDMMEACECPA1ACE2
SCHEMBL30051626 0.89 CTSD (0.57) CTSDMMEPSMB5
SCHEMBL3867735 0.89 CTSD (0.53) CTSDMMEACECPA1ACE2
SCHEMBL3867739 0.89 CTSD (0.53) CTSDMMEACECPA1ACE2
SCHEMBL15692336 0.88 PSMB5 (0.61) CTSDMMEACECPA1ACE2
SCHEMBL29658166 0.88 MME (0.60) CTSDMMEPSMB5
SCHEMBL29876711 0.86 ACE (0.58) CTSDMMEACECPA1ACE2
SCHEMBL15649661 0.86 ACE (0.61) CTSDMMEACECPA1ACE2
SCHEMBL15692294 0.86 MME (0.57) CTSDMMEACECPA1ACE2

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-4465625-A ANALGESICS RICHTER GEDEON VEGYESZETI GYAR (HU) 1984-08-14 — — US disclosed
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