SCHEMBL7765665

SCHEMBL7765665

N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)Nc1cccc2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.64
DPP8 Q6V1X1 3/20 0.56
DPP7 Q9UHL4 3/20 0.56
DPP4 P27487 2/20 0.52
DPP9 Q86TI2 2/20 0.52
HDAC1 Q13547 2/20 0.52
HDAC2 Q92769 2/20 0.52
HDAC3 O15379 1/20 0.52
HDAC4 P56524 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52
HDAC5 Q9UQL6 1/20 0.52
NCOR2 Q9Y618 1/20 0.52
SLC1A3 P43003 1/20 0.49
SLC1A1 P43005 1/20 0.49
PLAU P00749 1/20 0.48

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
SCHEMBL31060496 0.84 ANPEP (0.73) ANPEPDPP8DPP7DPP4DPP9
SCHEMBL7762702 0.82 ALDH1A1 (0.49) ANPEPKDM4EGSK3B
SCHEMBL7321298 0.82 ANPEP (0.71) ANPEPDPP8DPP7DPP4DPP9
Hydrochloric Acid SCHEMBL17133759 0.82 ANPEP (0.67) ANPEPDPP8DPP7DPP4DPP9
SCHEMBL7318869 0.80 ANPEP (0.68) ANPEPDPP8DPP7DPP4DPP9
SCHEMBL453671 0.80 DPP8 (0.69) ANPEPDPP8DPP7DPP4DPP9
SCHEMBL3704 0.80 DPP8 (0.69) ANPEPDPP8DPP7DPP4DPP9
SCHEMBL3703 0.80 DPP8 (0.69) ANPEPDPP8DPP7DPP4DPP9
SCHEMBL10962932 0.80 DPP8 (0.69) ANPEPDPP8DPP7DPP4DPP9
SCHEMBL5816135 0.80 DPP8 (0.69) ANPEPDPP8DPP7DPP4DPP9

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