SCHEMBL9354589

SCHEMBL9354589

CC(C)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)N(C)C(=O)[C@H](Cc1ccccc1)OC(=O)N(C)CCC(=O)N1CCSCC1

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.46

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
SCHEMBL7397828 0.93 REN (0.53) REN
Hydrochloric Acid SCHEMBL9354482 0.93 REN (0.53) REN
SCHEMBL9354816 0.91 REN (0.49) REN
SCHEMBL9354813 0.91 REN (0.49) REN
SCHEMBL9354929 0.91 REN (0.53) REN
SCHEMBL9354421 0.91 REN (0.45) REN
SCHEMBL9355226 0.91 REN (0.45) REN
SCHEMBL9354502 0.90 REN (0.52) REN
SCHEMBL9358228 0.90 REN (0.45) REN
SCHEMBL9358888 0.90 REN (0.48) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300189-B1 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1994-11-02 EP disclosed
EP-0300189-A2 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-01-25 EP disclosed