SCHEMBL7764101

SCHEMBL7764101

N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 3/20 0.62
DPP7 Q9UHL4 3/20 0.62
ANPEP P15144 1/20 0.60
DPP4 P27487 2/20 0.58
DPP9 Q86TI2 2/20 0.58
SLC1A3 P43003 1/20 0.55
SLC1A1 P43005 1/20 0.55
HTT P42858 1/20 0.54
FOLH1 Q04609 4/20 0.53
TGM2 P21980 1/20 0.52
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
Hydrochloric Acid SCHEMBL7762718 0.99 DPP8 (0.61) DPP8DPP7ANPEPDPP4DPP9
SCHEMBL5816135 0.85 DPP8 (0.69) DPP8DPP7ANPEPDPP4DPP9
SCHEMBL3703 0.85 DPP8 (0.69) DPP8DPP7ANPEPDPP4DPP9
SCHEMBL3704 0.85 DPP8 (0.69) DPP8DPP7ANPEPDPP4DPP9
SCHEMBL464672 0.85 DPP8 (0.69) DPP8DPP7ANPEPDPP4DPP9
SCHEMBL10962932 0.85 DPP8 (0.69) DPP8DPP7ANPEPDPP4DPP9
SCHEMBL453671 0.85 DPP8 (0.69) DPP8DPP7ANPEPDPP4DPP9
SCHEMBL30340611 0.84 DPP8 (0.60) DPP8DPP7ANPEPDPP4DPP9
SCHEMBL21219282 0.84 DPP8 (0.68) DPP8DPP7ANPEPDPP4DPP9
Hydrochloric Acid SCHEMBL20570522 0.84 DPP8 (0.68) DPP8DPP7ANPEPDPP4DPP9

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-0808839-B1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO LTD (JP) 2001-05-23 EP disclosed
US-5883121-A INHIBITING ACTIVITY AGAINST CATHEPSIN, AND IS USEFUL FOR PREVENTION AND TREATMENT OF OSTEOPATHY SUCH AS OSTEOPOROSIS TAIHO PHARMACEUTICAL CO., LTD. (JP) 1999-03-16 US disclosed
EP-0808839-A1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO., LTD. (JP) 1997-11-26 EP disclosed