SCHEMBL4946376

SCHEMBL4946376

CCCCN([C@@H](C)C(=O)O)[C@@H](C)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA9 Q16790 2/20 0.40
CA2 P00918 1/20 0.40
MAPK1 P28482 1/20 0.40
ACE2 Q9BYF1 1/20 0.39
GPR84 Q9NQS5 4/20 0.39
FFAR1 O14842 1/20 0.39
PPARD Q03181 2/20 0.38
MAPT P10636 1/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38
LCK P06239 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
CHRM1 P11229 1/20 0.36
AKR1A1 P14550 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL5319838 1.00 CA12 (0.40) CA12CA1CA9CA2MAPK1
SCHEMBL163902 0.91 ACE2 (0.46) ACE2GPR84FFAR1PPARDMAPT
SCHEMBL740194 0.91 ACE2 (0.46) ACE2GPR84FFAR1PPARDMAPT
SCHEMBL4945136 0.90 ALDH1A1 (0.34) CA12CA1CA9CA2MAPK1
SCHEMBL6673311 0.90 ACE2 (0.44) ACE2GPR84FFAR1PPARDMAPT
Hydrochloric Acid SCHEMBL4941451 0.89 CA12 (0.33) CA12CA1CA9CA2MAPK1
SCHEMBL11634475 0.82 GPR84 (0.46) ACE2GPR84FFAR1PPARDMAPT
SCHEMBL10982866 0.82 GPR84 (0.46) ACE2GPR84FFAR1PPARDMAPT
SCHEMBL28106316 0.82 GPR84 (0.41) CA2MAPK1ACE2GPR84FFAR1
SCHEMBL28856644 0.82 MMP1 (0.42) CA12CA1CA9CA2MAPK1

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-20080071094-A1 Process for the preparation of perindopril GLENMARK PHARMACEUTICALS LIMITED (IN) 2008-03-20 US disclosed
US-7291745-B2 Process for the preparation of perindopril GLENMARK PHARMACEUTICALS LIMITED (IN) 2007-11-06 US disclosed
WO-2007085933-A2 PROCESS FOR THE PREPARATION OF N-[1-(S)-ETHOXYCARBONYL-1-BUTYL]-(S)-ALANINE-DMT COMPLEX AND ITS USE IN THE PREPARATION OF PERINDOPRIL GLENMARK PHARMACEUTICALS LIMITED (US) 2007-08-02 WO disclosed
US-20060211867-A1 Process for the preparation of perindopril GLENMARK PHARMACEUTICALS LIMITED (IN) 2006-09-21 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 (2 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-20060211867-A1 Process for the preparation of perindopril ACE, PRSS1, CYP2S1 CA12 3514/4885CA1 2893/4885CA9 2772/4885
US-20080071094-A1 Process for the preparation of perindopril ACE, PRSS1, CYP2S1 CA12 3514/4885CA1 2893/4885CA9 2772/4885

“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.