SCHEMBL7764063

SCHEMBL7764063

NCCCC[C@H](NC(=O)C1OC1C(=O)NCCc1ccccc1)C(=O)Nc1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTMT1 Q9BV86 1/20 0.51
MMP1 P03956 1/20 0.43
MMP3 P08254 1/20 0.43
MMP9 P14780 1/20 0.43
TRPV1 Q8NER1 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GSK3B P49841 1/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
HSD17B10 Q99714 1/20 0.41
CALCRL Q16602 1/20 0.41
MC4R P32245 1/20 0.40
MC5R P33032 1/20 0.40
MC3R P41968 1/20 0.40
MC1R Q01726 1/20 0.40
METAP2 P50579 1/20 0.39
METAP1 P53582 1/20 0.39
ERAP2 Q6P179 1/20 0.39

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
SCHEMBL8349391 1.00 NTMT1 (0.51) NTMT1MMP1MMP3MMP9TRPV1
Hydrochloric Acid SCHEMBL7759028 0.99 NTMT1 (0.51) NTMT1MMP1MMP3MMP9TRPV1
Hydrochloric Acid SCHEMBL8344064 0.99 NTMT1 (0.51) NTMT1MMP1MMP3MMP9TRPV1
Hydrochloric Acid SCHEMBL8342864 0.95 NTMT1 (0.50) NTMT1MMP1MMP3MMP9MEN1
Hydrochloric Acid SCHEMBL7764068 0.95 NTMT1 (0.50) NTMT1MMP1MMP3MMP9MEN1
SCHEMBL7765678 0.93 NTMT1 (0.49) NTMT1MMP1MMP3MMP9TRPV1
SCHEMBL7761871 0.93 NTMT1 (0.49) NTMT1MMP1MMP3MMP9TRPV1
Hydrochloric Acid SCHEMBL7761875 0.93 NTMT1 (0.48) NTMT1MMP1MMP3MMP9MEN1
Hydrochloric Acid SCHEMBL7761862 0.93 NTMT1 (0.48) NTMT1MMP1MMP3MMP9MEN1
SCHEMBL8343138 0.88 NTMT1 (0.58) NTMT1MEN1KMT2AKDM4EGSK3B

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