SCHEMBL7300350

SCHEMBL7300350

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

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.42
SLC15A1 P46059 1/20 0.42
PLA2G10 O15496 2/20 0.42
MEN1 O00255 1/20 0.42
FAAH O00519 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
MMP8 P22894 1/20 0.41
EPHX1 P07099 4/20 0.40
SLC7A5 Q01650 1/20 0.40
RRM1 P23921 1/20 0.40
ANPEP P15144 2/20 0.38
RNPEP Q9H4A4 2/20 0.38
DNPEP Q9ULA0 1/20 0.38
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38

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
Bromide SCHEMBL7306533 0.98 DPP7 (0.41) DPP7SLC15A1PLA2G10MEN1FAAH
SCHEMBL13499200 0.77 SLC7A5 (0.54) SLC15A1MAPK1SLC7A5ANPEPRNPEP
SCHEMBL28866572 0.77 SLC7A5 (0.54) SLC15A1MAPK1SLC7A5ANPEPRNPEP
SCHEMBL11764942 0.76 DPP7 (0.61) DPP7MMP8EPHX1SLC7A5RRM1
SCHEMBL6035950 0.76 DPP7 (0.61) DPP7MMP8EPHX1SLC7A5RRM1
SCHEMBL3509475 0.76 DPP7 (0.61) DPP7MMP8EPHX1SLC7A5RRM1
SCHEMBL12857274 0.75 SLC7A5 (0.48) SLC7A5ANPEPRNPEPDNPEP
SCHEMBL7303256 0.75 SLC7A5 (0.48) MEN1FAAHKMT2ASLC7A5ANPEP
SCHEMBL18796578 0.74 FAAH (0.50) SLC15A1PLA2G10MEN1FAAHMAPK1
SCHEMBL7303261 0.74 PAOX (0.47) MEN1KMT2ASLC7A5ANPEPRNPEP

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
US-5214056-A Thiol protease inhibitors JAPAN TOBACCO INC. (JP) 1993-05-25 US disclosed
EP-0460239-A1 1,3,2-DIOXATHIOLANE OXIDE DERIVATIVE Japan Tobacco Inc. (JP) 1991-12-11 EP disclosed