SCHEMBL7990281

SCHEMBL7990281

C=CCCCN(C(=O)C(N)C(C)C)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.36
SLC7A5 Q01650 1/20 0.31
EPHX2 P34913 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
ABCC4 O15439 1/20 0.31
MAPT P10636 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
SCHEMBL7990278 1.00 DPP4 (0.36) DPP4SLC7A5EPHX2ALDH1A1LMNA
SCHEMBL7994206 0.82 DPP4 (0.47) DPP4SLC7A5ALDH1A1LMNAABCC4
SCHEMBL7994208 0.82 DPP4 (0.47) DPP4SLC7A5ALDH1A1LMNAABCC4
SCHEMBL7986467 0.77 DPP4 (0.46) DPP4SLC7A5EPHX2ALDH1A1LMNA
SCHEMBL7986473 0.77 DPP4 (0.46) DPP4SLC7A5EPHX2ALDH1A1LMNA
SCHEMBL7986822 0.76 EPHX2 (0.32) EPHX2ALDH1A1LMNAABCC4MAPT
SCHEMBL7986849 0.75 DPP4 (0.32) DPP4
SCHEMBL7986851 0.75 DPP4 (0.32) DPP4
SCHEMBL7990372 0.71 ALDH1A1 (0.33) DPP4ALDH1A1LMNAABCC4MAPT
SCHEMBL7990370 0.71 ALDH1A1 (0.33) DPP4ALDH1A1LMNAABCC4MAPT

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