SCHEMBL7733119

SCHEMBL7733119

CC(C)(C)OC(=O)N[C@@H]1CCCN1C(Cc1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.50
KMT2A Q03164 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KLK5 Q9Y337 1/20 0.48
MAPK1 P28482 1/20 0.44
SCN9A Q15858 2/20 0.44
CMA1 P23946 5/20 0.44
ATM Q13315 1/20 0.42

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
SCHEMBL6689176 1.00 ACE (0.50) ACEKMT2AL3MBTL1KLK5MAPK1
Hydrochloric Acid SCHEMBL7952862 0.99 ACE (0.49) ACEKMT2AL3MBTL1KLK5MAPK1
Hydrochloric Acid SCHEMBL7949418 0.99 ACE (0.49) ACEKMT2AL3MBTL1KLK5MAPK1
SCHEMBL7710458 0.78 KMT2A (0.60) ACEKMT2AL3MBTL1KLK5
SCHEMBL10006082 0.78 SCN9A (0.40) ACESCN9A
SCHEMBL20488646 0.77 KMT2A (0.43) ACEKMT2AL3MBTL1
SCHEMBL5166032 0.76 CTSS (0.47) ACEKMT2AMAPK1ATM
SCHEMBL6172743 0.76 L3MBTL1 (0.51) KMT2AL3MBTL1
SCHEMBL5168741 0.76 CTSS (0.47) ACEKMT2AMAPK1ATM
Hydrochloric Acid SCHEMBL7941347 0.75 CTSS (0.47) ACEKMT2AMAPK1ATM

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-6407059-B1 SOMATOSTATIN-TYPE DRUG PEPTOR LIMITED (IL) 2002-06-18 US disclosed
US-5811392-A BRADYKININ ANTAGONISTS; SOMATOSTATIN ANALOGS YISSUM RESEARCH DEVELOPMENT CO. OF THE HEBREW UNIVERSITY (IL) 1998-09-22 US disclosed