SCHEMBL9674244

SCHEMBL9674244

CC(C)(C)OC(=O)NC1CCN(C(=O)N[C@@H](Cc2ccccc2)C(=O)NCCC(=O)N[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)C2CC2)CC1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.63
KDM4E B2RXH2 1/20 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
SCHEMBL9674226 0.99 REN (0.63) RENKDM4E
SCHEMBL9676876 0.93 REN (0.66) REN
SCHEMBL9659399 0.91 REN (0.63) RENKDM4E
SCHEMBL9676817 0.91 REN (0.63) REN
SCHEMBL9676710 0.90 REN (0.62) REN
SCHEMBL9674884 0.89 REN (0.58) REN
SCHEMBL9660746 0.89 REN (0.64) RENKDM4E
SCHEMBL9676873 0.89 REN (0.53) REN
SCHEMBL9676310 0.87 REN (0.50) REN
SCHEMBL9674662 0.87 REN (0.50) 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
EP-0499080-A2 Aminoacid derivatibes MERCK PATENT GmbH (DE) 1992-08-19 EP disclosed