SCHEMBL8771862

SCHEMBL8771862

CCc1ncnc(OCC(C)NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACACB O00763 17/20 0.36

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
SCHEMBL8771843 0.73 TRPA1 (0.44) ACACB
SCHEMBL8771916 0.68 LMNA (0.43)
SCHEMBL8602879 0.67 SCN4A (0.34) ACACB
SCHEMBL8771962 0.67 MAPT (0.49) ACACB
SCHEMBL8771891 0.65 LMNA (0.41)
SCHEMBL8097370 0.65 MAP3K8 (0.41)
SCHEMBL4000328 0.64 MAPK1 (0.42)
SCHEMBL21676258 0.64 CTSK (0.38)
SCHEMBL7563765 0.63 ALDH1A1 (0.47) ACACB
SCHEMBL7563131 0.62 PRCP (0.46)

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-0648740-B1 AMINO ACID AMIDE DERIVATIVE, AGROHORTICULTURAL BACTERICIDE, AND PRODUCTION PROCESS KUMIAI CHEMICAL INDUSTRY CO (JP) 1997-10-08 EP disclosed
EP-0648740-A1 AMINO ACID AMIDE DERIVATIVE, AGROHORTICULTURAL BACTERICIDE, AND PRODUCTION PROCESS KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1995-04-19 EP disclosed