SCHEMBL20769313

SCHEMBL20769313

CC(C)CC(NC(=O)C(Cc1ccccc1)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)CN)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 3/20 0.58
▸ OPRK1 P41145 3/20 0.57
▸ F2 P00734 1/20 0.56
▸ PSMB9 P28065 2/20 0.55
▸ REN P00797 1/20 0.55
▸ NTSR2 O95665 6/20 0.55
▸ NTSR1 P30989 5/20 0.55
▸ SORT1 Q99523 4/20 0.55
▸ OPRM1 P35372 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
SCHEMBL20769315 1.00 ACE (0.58) ACEOPRK1F2PSMB9REN
SCHEMBL20769314 1.00 ACE (0.58) ACEOPRK1F2PSMB9REN
SCHEMBL31512206 0.97 ACE (0.58) ACEOPRK1F2PSMB9REN
SCHEMBL30469506 0.90 ACE (0.59) ACEOPRK1F2OPRM1
SCHEMBL2195454 0.88 OPRD1 (0.55) ACEOPRK1F2PSMB9REN
SCHEMBL29473876 0.87 CAPN1 (0.47) ACENTSR2NTSR1SORT1OPRM1
SCHEMBL30259604 0.85 REN (0.53) ACEOPRK1F2RENNTSR2
SCHEMBL3221787 0.85 OPRK1 (0.59) OPRK1F2NTSR2NTSR1OPRM1
SCHEMBL3221767 0.85 OPRK1 (0.59) OPRK1F2NTSR2NTSR1OPRM1
Thymoctonan SCHEMBL15532000 0.85 REN (0.52) ACEOPRK1F2RENNTSR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190070251-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS 2019-03-07 — — 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-20190070251-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP ACE 1799/4885OPRK1 2737/4885F2 2099/4885

“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.

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