SCHEMBL9724084

SCHEMBL9724084

CCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(F)Cc1ccccn1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.55
CTSE P14091 6/20 0.51
CTSD P07339 5/20 0.51
PGA5 P0DJD9 3/20 0.51
PGC P20142 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
SCHEMBL7286103 0.89 REN (0.59) REN
SCHEMBL9724094 0.89 REN (0.55) RENCTSE
SCHEMBL7284745 0.84 REN (0.61) REN
SCHEMBL7283881 0.82 REN (0.60) REN
SCHEMBL7283775 0.81 REN (0.59) REN
SCHEMBL7293569 0.81 REN (0.59) REN
SCHEMBL9724073 0.81 REN (0.52) RENCTSECTSD
SCHEMBL7293194 0.80 CTSL (0.52) REN
SCHEMBL7287419 0.79 REN (0.60) REN
SCHEMBL7288827 0.79 REN (0.59) REN

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-5116835-A Hypotensive agents HOECHST AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed