SCHEMBL3705693

SCHEMBL3705693

O=C(O)CC1(C(=O)NC(Cc2ccccc2)C(=O)N2CCCC2C(=O)O)Cc2ccccc2C1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACE P12821 15/20 0.54
ACE2 Q9BYF1 10/20 0.54
TSHR P16473 1/20 0.52
LTA4H P09960 2/20 0.51

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
SCHEMBL3705691 1.00 ACE (0.54) ACEACE2TSHRLTA4H
SCHEMBL3699233 0.96 MME (0.51) ACEACE2TSHRLTA4H
SCHEMBL7540259 0.90 ACE (0.55) ACEACE2TSHRLTA4H
SCHEMBL6119115 0.88 TSHR (0.47) ACEACE2TSHRLTA4H
SCHEMBL3701543 0.86 MME (0.52) ACEACE2TSHRLTA4H
SCHEMBL7543519 0.86 MME (0.52) ACEACE2TSHRLTA4H
SCHEMBL6118907 0.86 MME (0.52) ACEACE2TSHRLTA4H
SCHEMBL6118091 0.84 ACE (0.51) ACEACE2TSHR
SCHEMBL6442125 0.79 ACE (0.74) ACEACE2LTA4H
SCHEMBL6442128 0.79 ACE (0.74) ACEACE2LTA4H

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 4 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
EP-2640689-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP INHIBITORS Novartis AG (CH) 2013-09-25 EP disclosed
WO-2012065953-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP INHIBITORS NOVARTIS AG (CH) 2012-05-24 WO 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 ACE 7/4885ACE2 29/4885TSHR 3478/4885

“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.