SCHEMBL7538528

SCHEMBL7538528

CCOC(=O)CC1(C(=O)N[C@@H](Cc2ccc(-c3ccccc3)cc2)C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)CCCC1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMEL1 Q495T6 1/20 0.57
ACE P12821 8/20 0.52
FKBP1A P62942 8/20 0.47
REN P00797 1/20 0.43
LMNA P02545 1/20 0.42
ACE2 Q9BYF1 2/20 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
SCHEMBL6119591 1.00 MMEL1 (0.57) MMEL1ACEFKBP1ARENLMNA
SCHEMBL6119582 1.00 MMEL1 (0.57) MMEL1ACEFKBP1ARENLMNA
SCHEMBL7537478 0.97 MMEL1 (0.53) MMEL1ACEFKBP1ARENLMNA
SCHEMBL6119055 0.95 ACE (0.51) MMEL1ACEFKBP1AREN
SCHEMBL7539217 0.95 ACE (0.51) MMEL1ACEFKBP1AREN
SCHEMBL7540635 0.93 ACE (0.50) MMEL1ACEFKBP1ARENACE2
SCHEMBL3695367 0.91 ACE (0.49) MMEL1ACELMNAACE2
SCHEMBL3695364 0.91 ACE (0.49) MMEL1ACELMNAACE2
SCHEMBL7544573 0.91 ACE (0.49) MMEL1ACELMNAACE2
SCHEMBL7537880 0.90 ACE (0.52) MMEL1ACEFKBP1ARENACE2

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-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

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 MMEL1 1000/4885ACE 7/4885FKBP1A 3240/4885

“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.