SCHEMBL7279294

SCHEMBL7279294

CC/C(=C/[C@H](O)[C@@H](N)CC(C)C)C(=O)NCC(C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 3/20 0.41
DNPEP Q9ULA0 2/20 0.41
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
MAPT P10636 2/20 0.33
RNPEP Q9H4A4 2/20 0.33
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
MMP1 P03956 1/20 0.31
MMP8 P22894 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
PSMB5 P28074 1/20 0.31
EPHX1 P07099 1/20 0.30
SLC7A5 Q01650 1/20 0.30

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
SCHEMBL7288179 1.00 ANPEP (0.41) ANPEPDNPEPCYP2D6CYP2C19MAPT
SCHEMBL7284497 0.89 ANPEP (0.39) ANPEPDNPEPCYP2D6CYP2C19MAPT
SCHEMBL7278906 0.89 ANPEP (0.39) ANPEPDNPEPCYP2D6CYP2C19MAPT
SCHEMBL7317760 0.83 ANPEP (0.38) ANPEPDNPEPCYP2D6CYP2C19MAPT
SCHEMBL7285895 0.81 ANPEP (0.42) ANPEPDNPEPCYP2D6CYP2C19MAPT
SCHEMBL7278660 0.81 ANPEP (0.42) ANPEPDNPEPCYP2D6CYP2C19MAPT
SCHEMBL14553257 0.73 CYP2D6 (0.46) CYP2D6CYP2C19MAPTMEN1ALDH1A1
SCHEMBL7294441 0.71 ANPEP (0.44) ANPEPDNPEPCYP2D6CYP2C19MAPT
SCHEMBL7287058 0.71 ANPEP (0.44) ANPEPDNPEPCYP2D6CYP2C19MAPT
SCHEMBL7285114 0.71 GRIK1 (0.37) ANPEPDNPEPPSMB5SLC7A5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0272583-B1 5-SUBSTITUTED AMINO-4-HYDROXY-PENTENOIC ACID DERIVATIVES AND THEIR USE Banyu Pharmaceutical Co., Ltd. (JP) 1993-09-15 EP disclosed
US-4927565-A HYPOTENSIVE AGENT BANYU PHARMACEUTICAL CO., LTD. (JP) 1990-05-22 US disclosed
EP-0272583-A2 5-Substituted amino-4-hydroxy-pentenoic acid derivatives and their use Banyu Pharmaceutical Co., Ltd. (JP) 1988-06-29 EP disclosed