SCHEMBL7975796

SCHEMBL7975796

C=CCCCN(C)C(=O)[C@@H](NC(=O)O)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
ABCC4 O15439 1/20 0.32
MAPT P10636 1/20 0.32
PDF Q9HBH1 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL7990041 0.96 ALDH1A1 (0.34) ALDH1A1LMNAABCC4MAPTPDF
SCHEMBL7986213 0.85 ALDH1A1 (0.33) ALDH1A1LMNAABCC4MAPT
SCHEMBL7986818 0.84 EPHX2 (0.32) ALDH1A1LMNAABCC4MAPT
SCHEMBL7986822 0.84 EPHX2 (0.32) ALDH1A1LMNAABCC4MAPT
SCHEMBL7989547 0.81 PDF (0.43) ALDH1A1LMNAABCC4MAPTPDF
SCHEMBL7977102 0.81 PDF (0.44) PDF
SCHEMBL7976169 0.81 PDF (0.44) PDF
SCHEMBL7990402 0.80 PSEN1 (0.37) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL7990404 0.80 PSEN1 (0.37) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL1274009 0.79 SMN1; SMN2 (0.37) ALDH1A1LMNAABCC4MAPT

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
WO-2001040198-A2 MACROCYCLIC HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTIMICROBIAL AGENTS AVENTIS PHARMA S.A. (FR) 2001-06-07 WO disclosed