SCHEMBL428265

SCHEMBL428265

CCc1cc(OC)ccc1C[C@H](NN[C@@H](Cc1ccccc1)C(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
ALOX15 P16050 1/20 0.54
FPR2 P25090 1/20 0.53
CAPN1 P07384 2/20 0.50
KMT2A Q03164 1/20 0.50
POLB P06746 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
PPARG P37231 1/20 0.48
PPARA Q07869 1/20 0.48
KEAP1 Q14145 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
GPR139 Q6DWJ6 1/20 0.46
GAA P10253 1/20 0.46
ADORA2A P29274 1/20 0.45

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
SCHEMBL3156701 1.00 ALDH1A1 (0.54) ALDH1A1ALOX15FPR2CAPN1KMT2A
SCHEMBL1702385 0.87 FPR2 (0.55) ALDH1A1ALOX15FPR2KMT2APPARG
SCHEMBL1395877 0.84 FPR2 (0.67) ALDH1A1ALOX15FPR2KMT2APPARG
SCHEMBL1702272 0.83 PPARG (0.47) ALDH1A1ALOX15PPARGPPARAKEAP1
SCHEMBL5080118 0.82 CAPN1 (0.40) ALDH1A1ALOX15FPR2CAPN1KMT2A
SCHEMBL5215651 0.78 ALDH1A1 (0.67) ALDH1A1ALOX15FPR2KMT2AGAA
SCHEMBL7390734 0.78 ALDH1A1 (0.67) ALDH1A1ALOX15FPR2KMT2AGAA
SCHEMBL2003954 0.78 ITGA4 (0.41) ALDH1A1ALOX15FPR2CAPN1KMT2A
SCHEMBL157547 0.76 MME (0.61) NPSR1MMP2MMP9
SCHEMBL20232564 0.76 HSD17B10 (0.46) POLB

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200399311-A1 NOVEL PEPTIDE BASED PCSK9 VACCINE ZYDUS LIFESCIENCES LIMITED (IN) 2020-12-24 US claimed
EP-3609532-A1 NOVEL PEPTIDE BASED PCSK9 VACCINE Cadila Healthcare Limited (IN) 2020-02-19 EP claimed
WO-2018189705-A1 NOVEL PEPTIDE BASED PCSK9 VACCINE CADILA HEALTHCARE LIMITED (IN) 2018-10-18 WO claimed
US-8383581-B2 Short-chain peptides as parathyroid hormone (PTH) receptor agonist CADILA HEALTHCARE LIMITED (IN) 2013-02-26 US claimed
US-20120264685-A1 SHORT CHAIN PEPTIDOMIMETICS BASED ORALLY ACTIVE GLP 1 AGONIST AND GLUCAGON RECEPTOR ANTAGONIST CADILA HEALTHCARE LIMITED (IN) 2012-10-18 US claimed
WO-2012120532-A2 CYCLIC SHORT CHAIN PEPTIDES CADILA HEALTHCARE LIMITED (IN) 2012-09-13 WO claimed
EP-2491054-A2 SHORT CHAIN PEPTIDOMIMETICS BASED ORALLY ACTIVE GLP-1 AGONIST AND GLUCAGON RECEPTOR ANTAGONIST Cadila Healthcare Limited (IN) 2012-08-29 EP claimed
US-20120108496-A1 SHORT-CHAIN PEPTIDES AS PARATHYROID HORMONE (PTH) RECEPTOR AGONIST CADILA HEALTHCARE LIMITED (IN) 2012-05-03 US claimed
EP-2421893-A2 SHORT-CHAIN PEPTIDES AS PARATHYROID HORMONE (PTH) RECEPTOR AGONIST Cadila Healthcare Limited (IN) 2012-02-29 EP claimed
WO-2011048614-A2 SHORT CHAIN PEPTIDOMIMETICS BASED ORALLY ACTIVE GLP-1 AGONIST AND GLUCAGON RECEPTOR ANTAGONIST CADILA HEALTHCARE LIMITED (IN) 2011-04-28 WO claimed
WO-2010128521-A2 SHORT-CHAIN PEPTIDES AS PARATHYROID HORMONE (PTH) RECEPTOR AGONIST CADILA HEALTHCARE LIMITED (IN) 2010-11-11 WO claimed
US-11325945-B2 Peptide based PCSK9 vaccine CADILA HEALTHCARE LIMITED (IN) 2022-05-10 US disclosed
US-20200399311-A1 NOVEL PEPTIDE BASED PCSK9 VACCINE ZYDUS LIFESCIENCES LIMITED (IN) 2020-12-24 US disclosed
EP-3609532-A1 NOVEL PEPTIDE BASED PCSK9 VACCINE Cadila Healthcare Limited (IN) 2020-02-19 EP disclosed
WO-2018189705-A1 NOVEL PEPTIDE BASED PCSK9 VACCINE CADILA HEALTHCARE LIMITED (IN) 2018-10-18 WO disclosed
US-20120021972-A1 PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP 1 AGONISTIC ACTIVITIES CADILA HEALTHCARE LIMITED (IN) 2012-01-26 US disclosed
WO-2011048614-A2 SHORT CHAIN PEPTIDOMIMETICS BASED ORALLY ACTIVE GLP-1 AGONIST AND GLUCAGON RECEPTOR ANTAGONIST CADILA HEALTHCARE LIMITED (IN) 2011-04-28 WO disclosed
WO-2010128521-A2 SHORT-CHAIN PEPTIDES AS PARATHYROID HORMONE (PTH) RECEPTOR AGONIST CADILA HEALTHCARE LIMITED (IN) 2010-11-11 WO disclosed
EP-2231701-A2 PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP-1 AGONISTIC ACTIVITIES Cadila Healthcare Limited (IN) 2010-09-29 EP disclosed
WO-2009125424-A2 PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP-1 AGONISTIC ACTIVITIES CADILA HEALTHCARE LIMITED (IN) 2009-10-15 WO 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 (5 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-20120108496-A1 SHORT-CHAIN PEPTIDES AS PARATHYROID HORMONE (PTH) RECEPTOR AGONIST PTH1R, GIPR, PTMS ALDH1A1 3467/4885ALOX15 325/4885FPR2 563/4885
US-11325945-B2 Peptide based PCSK9 vaccine PCSK9, PCSK7, PCSK6 ALDH1A1 4756/4885ALOX15 147/4885FPR2 265/4885
US-20120264685-A1 SHORT CHAIN PEPTIDOMIMETICS BASED ORALLY ACTIVE GLP 1 AGONIST AND GLUCAGON RECEPTOR ANTAGONIST GIPR, GLP1R, DPP4 ALDH1A1 2704/4885ALOX15 1790/4885FPR2 2288/4885
US-20200399311-A1 NOVEL PEPTIDE BASED PCSK9 VACCINE PCSK9, PCSK7, PCSK6 ALDH1A1 4683/4885ALOX15 202/4885FPR2 392/4885
US-20120021972-A1 PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP 1 AGONISTIC ACTIVITIES GLP1R, GPR119, GIPR ALDH1A1 3147/4885ALOX15 3473/4885FPR2 414/4885

“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.