SCHEMBL7293194

SCHEMBL7293194

CCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CCCc1ccccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.52
CTSB P07858 2/20 0.52
CTSS P25774 7/20 0.50
REN P00797 7/20 0.48
PSMB11 A5LHX3 1/20 0.42
PSMA7 O14818 1/20 0.42
PSMB1 P20618 1/20 0.42
PSMA1 P25786 1/20 0.42
PSMA2 P25787 1/20 0.42
PSMA3 P25788 1/20 0.42
PSMA4 P25789 1/20 0.42
PSMB8 P28062 1/20 0.42
PSMB9 P28065 1/20 0.42
PSMA5 P28066 1/20 0.42
PSMB4 P28070 1/20 0.42
PSMB6 P28072 1/20 0.42
PSMB5 P28074 1/20 0.42
PSMB10 P40306 1/20 0.42
PSMB3 P49720 1/20 0.42
PSMB2 P49721 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
SCHEMBL7286103 0.91 REN (0.59) CTSLCTSBCTSSREN
SCHEMBL7284745 0.84 REN (0.61) REN
SCHEMBL7293816 0.84 REN (0.48) CTSLCTSBCTSSRENPSMB11
SCHEMBL7283881 0.83 REN (0.60) REN
SCHEMBL7283775 0.82 REN (0.59) REN
SCHEMBL7293569 0.82 REN (0.59) REN
SCHEMBL7287419 0.80 REN (0.60) REN
SCHEMBL9724084 0.80 REN (0.55) REN
SCHEMBL7288827 0.80 REN (0.59) REN
SCHEMBL9724073 0.79 REN (0.52) CTSLCTSBCTSSREN

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-5116835-A Hypotensive agents HOECHST AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed
EP-0372537-A2 Urea derivatives of dipeptides with enzyme-inhibiting properties, process to make them, compositions containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-13 EP disclosed