SCHEMBL7989844

SCHEMBL7989844

C=CCCCN(C)C(=O)[C@@H](N)[C@H](C)CC

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 14/20 0.34
DPP8 Q6V1X1 8/20 0.33
DPP9 Q86TI2 7/20 0.33
DPP7 Q9UHL4 7/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 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
SCHEMBL7990335 1.00 DPP4 (0.34) DPP4DPP8DPP9DPP7ALDH1A1
SCHEMBL7994206 0.86 DPP4 (0.47) DPP4ALDH1A1
SCHEMBL7994208 0.86 DPP4 (0.47) DPP4ALDH1A1
SCHEMBL7990370 0.82 ALDH1A1 (0.33) DPP4ALDH1A1TSHR
SCHEMBL7990372 0.82 ALDH1A1 (0.33) DPP4ALDH1A1TSHR
SCHEMBL7986467 0.81 DPP4 (0.46) DPP4ALDH1A1TSHR
SCHEMBL7986473 0.81 DPP4 (0.46) DPP4ALDH1A1TSHR
SCHEMBL7975696 0.77 SLC7A5 (0.39) ALDH1A1
SCHEMBL7975699 0.77 SLC7A5 (0.39) ALDH1A1
SCHEMBL7986244 0.76 NOS3 (0.39) DPP4DPP8DPP9DPP7ALDH1A1

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