SCHEMBL646159

SCHEMBL646159

O=C(O)[C@@H]1C[C@@H]2CCC[C@@H]2N1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.48
KMT2A Q03164 4/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 2/20 0.45
ACE P12821 4/20 0.45
MEN1 O00255 2/20 0.44
ALOX15 P16050 1/20 0.44
USP2 O75604 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
OPRK1 P41145 1/20 0.43
AGTR2 P50052 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
Hydrochloric Acid SCHEMBL16766056 0.99 CYP3A4 (0.47) CYP3A4KMT2AKDM4EALDH1A1LMNA
SCHEMBL5954481 0.97 CYP3A4 (0.48) CYP3A4KMT2AKDM4EALDH1A1LMNA
SCHEMBL4399111 0.97 CYP3A4 (0.48) CYP3A4KMT2AKDM4EALDH1A1LMNA
SCHEMBL4616899 0.97 CYP3A4 (0.48) CYP3A4KMT2AKDM4EALDH1A1LMNA
SCHEMBL4399114 0.97 CYP3A4 (0.48) CYP3A4KMT2AKDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL5593751 0.96 ACE (0.49) CYP3A4KMT2AKDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL5793334 0.96 ACE (0.49) CYP3A4KMT2AKDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL4616123 0.96 ACE (0.49) CYP3A4KMT2AKDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL5791761 0.96 ACE (0.49) CYP3A4KMT2AKDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL5549564 0.96 ACE (0.49) CYP3A4KMT2AKDM4EALDH1A1LMNA

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-8119375-B2 Method for the production of ramipril SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2012-02-21 US disclosed
US-20090017509-A1 METHOD FOR THE PRODUCTION OF RAMIPRIL SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-01-15 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-20090017509-A1 METHOD FOR THE PRODUCTION OF RAMIPRIL REN, PDE8B, PDE3A CYP3A4 37/4885KMT2A 2722/4885KDM4E 2521/4885

“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.