SCHEMBL1421733

SCHEMBL1421733

CCC(C)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C1CCCN1C(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(Cc1ccccc1)NC(=O)C(Cc1ccccc1)NC(=O)[C@@H](CCCCN)NC(=O)C(N)Cc1ccc(O)cc1)C(=O)NC(CC(C)C)C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NTSR1 P30989 9/20 0.74
NTSR2 O95665 6/20 0.74
OPRD1 P41143 5/20 0.74
OPRM1 P35372 1/20 0.74
OPRK1 P41145 1/20 0.74
SORT1 Q99523 4/20 0.74

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
SCHEMBL1421754 1.00 NTSR1 (0.74) NTSR1NTSR2OPRD1OPRM1OPRK1
SCHEMBL30880437 0.95 NTSR1 (0.82) NTSR1NTSR2SORT1
SCHEMBL1421938 0.94 OPRD1 (0.69) NTSR1NTSR2OPRD1OPRM1OPRK1
SCHEMBL1421888 0.94 OPRD1 (0.69) NTSR1NTSR2OPRD1OPRM1OPRK1
SCHEMBL1421931 0.94 OPRD1 (0.69) NTSR1NTSR2OPRD1OPRM1OPRK1
SCHEMBL1421906 0.94 OPRD1 (0.69) NTSR1NTSR2OPRD1OPRM1OPRK1
SCHEMBL31124658 0.93 OPRD1 (0.67) NTSR1NTSR2OPRD1OPRM1OPRK1
SCHEMBL12521276 0.93 OPRD1 (0.68) NTSR1NTSR2OPRD1OPRM1OPRK1
SCHEMBL29583282 0.92 NTSR1 (0.73) NTSR1NTSR2OPRD1SORT1
SCHEMBL29702258 0.92 NTSR1 (0.73) NTSR1NTSR2OPRD1SORT1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8551939-B2 Peptide analogues, particularly for the treatment of chronic pain INSTYTUT MEDYCYNY DOSWIADCZALNEJ I KLINICZNEJ (PL) 2013-10-08 US claimed
EP-2297179-B1 PEPTIDE ANALOGUES, PARTICULARLY FOR THE TREATMENT OF CHRONIC PAIN INST MEDYCYNY DOSWIADCZALNEJ I KLINICZNEJ IM MIROSLAWA MOSSAKOWSKIEGO POLSKIEJ AKADEMII NAUK (PL) 2012-09-26 EP claimed
US-20110166083-A1 PEPTIDE ANALOGUES, PARTICULARLY FOR THE TREATMENT OF CHRONIC PAIN INSTYTUT MEDYCYNY DOSWIADCZALNEJ I KLINICZNEJ (PL) 2011-07-07 US claimed
EP-2297179-A1 PEPTIDE ANALOGUES, PARTICULARLY FOR THE TREATMENT OF CHRONIC PAIN Instytut Medycyny Doswiadczalnej I Klinicznej Im. Miroslawa Mossakowskiego Polskiej Akademii Nauk (PL) 2011-03-23 EP claimed
WO-2009148343-A1 PEPTIDE ANALOGUES, PARTICULARLY FOR THE TREATMENT OF CHRONIC PAIN INSTYTUT MEDYCYNY DOŚWIADCZALNEJ I KLINICZNEJ IM. MIROSŁAWA MOSSAKOWSKIEGO POLSKIEJ AKADEMII NAUK (PL) 2009-12-10 WO claimed
US-8551939-B2 Peptide analogues, particularly for the treatment of chronic pain INSTYTUT MEDYCYNY DOSWIADCZALNEJ I KLINICZNEJ (PL) 2013-10-08 US disclosed
EP-2297179-B1 PEPTIDE ANALOGUES, PARTICULARLY FOR THE TREATMENT OF CHRONIC PAIN INST MEDYCYNY DOSWIADCZALNEJ I KLINICZNEJ IM MIROSLAWA MOSSAKOWSKIEGO POLSKIEJ AKADEMII NAUK (PL) 2012-09-26 EP disclosed
US-20110166083-A1 PEPTIDE ANALOGUES, PARTICULARLY FOR THE TREATMENT OF CHRONIC PAIN INSTYTUT MEDYCYNY DOSWIADCZALNEJ I KLINICZNEJ (PL) 2011-07-07 US disclosed
EP-2297179-A1 PEPTIDE ANALOGUES, PARTICULARLY FOR THE TREATMENT OF CHRONIC PAIN Instytut Medycyny Doswiadczalnej I Klinicznej Im. Miroslawa Mossakowskiego Polskiej Akademii Nauk (PL) 2011-03-23 EP disclosed
WO-2009148343-A1 PEPTIDE ANALOGUES, PARTICULARLY FOR THE TREATMENT OF CHRONIC PAIN INSTYTUT MEDYCYNY DOŚWIADCZALNEJ I KLINICZNEJ IM. MIROSŁAWA MOSSAKOWSKIEGO POLSKIEJ AKADEMII NAUK (PL) 2009-12-10 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 (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-20110166083-A1 PEPTIDE ANALOGUES, PARTICULARLY FOR THE TREATMENT OF CHRONIC PAIN OPRL1, OPRK1, NTSR2 NTSR1 4/4885NTSR2 3/4885OPRD1 9/4885

“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.