SCHEMBL7537159

SCHEMBL7537159

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACE P12821 5/20 0.63
KLK5 Q9Y337 1/20 0.59
CMA1 P23946 8/20 0.58
F2 P00734 1/20 0.58
PRSS1 P07477 1/20 0.58
CTSL P07711 1/20 0.55
FKBP1A P62942 2/20 0.55
KMT2A Q03164 1/20 0.53

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
SCHEMBL7148899 1.00 ACE (0.63) ACEKLK5CMA1F2PRSS1
SCHEMBL7538363 0.96 ACE (0.59) ACEKLK5CMA1F2PRSS1
SCHEMBL7272846 0.96 ACE (0.59) ACEKLK5CMA1F2PRSS1
SCHEMBL7539511 0.96 ACE (0.59) ACEKLK5CMA1F2PRSS1
SCHEMBL25448062 0.94 ACE (0.57) ACEKLK5CMA1F2PRSS1
SCHEMBL6435112 0.94 ACE (0.57) ACEKLK5CMA1F2PRSS1
SCHEMBL8366751 0.94 ACE (0.56) ACEKLK5CMA1F2PRSS1
SCHEMBL7321218 0.93 ACE (0.60) ACEKLK5CMA1F2PRSS1
SCHEMBL10403794 0.93 ACE (0.56) ACEKLK5CMA1F2PRSS1
SCHEMBL7268512 0.91 KLK5 (0.69) ACEKLK5CMA1F2PRSS1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877815-B2 Substituted carbamoylcycloalkyl acetic acid derivatives as NEP NOVARTIS AG (CH) 2014-11-04 US disclosed
US-20120122764-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP NOVARTIS AG (CH) 2012-05-17 US disclosed
US-5494898-A DIQUATERNARY TRIPEPTIDES OHMEDA PHARMACEUTICAL PRODUCTS DIVISION INC. (US) 1996-02-27 US disclosed
EP-0498941-A2 Peptide skeletal muscle relaxants BOC Health Care, Inc. (US) 1992-08-19 EP disclosed
US-4971993-A HYPOTENSIVE DIPEPTIDES DERIVATIVES AJINOMOTO CO., INC. (JP) 1990-11-20 US disclosed
EP-0190852-A2 Dipeptide derivatives and antihypertensive drugs containing them AJINOMOTO CO., INC. (JP) 1986-08-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120122764-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP MME, REN, ECE1 ACE 7/4885KLK5 428/4885CMA1 45/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.