SCHEMBL30758138

SCHEMBL30758138

N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@@H](N)CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 9/20 0.45
NPY1R P25929 5/20 0.45
NPY2R P49146 4/20 0.45
NPY5R Q15761 4/20 0.45
GNAI3 P08754 1/20 0.43
GNAO1 P09471 1/20 0.43
GNAI1 P63096 1/20 0.43
TERT O14746 1/20 0.42
OPRL1 P41146 3/20 0.41
TLR2 O60603 1/20 0.41
SIRT6 Q8N6T7 1/20 0.40
SIRT1 Q96EB6 1/20 0.40

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
SCHEMBL30819414 0.96 GNAI3 (0.46) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL30254242 0.90 GNAI3 (0.43) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL22133166 0.89 TLR2 (0.44) NPY4RNPY1RNPY2RNPY5RTLR2
SCHEMBL31678957 0.89 TERT (0.50) GNAI3GNAO1GNAI1TERTTLR2
SCHEMBL31691755 0.88 NPY4R (0.44) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL31406583 0.88 NOD1 (0.47) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL22342260 0.88 TLR2 (0.43) NPY4RNPY1RNPY2RNPY5RTLR2
SCHEMBL30497050 0.88 NOD1 (0.47) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL16409463 0.88 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5ROPRL1
SCHEMBL17955405 0.88 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RGNAI3

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-20230416329-A1 A PEPTIDE WITH DISULFIDE BONDS AND INHIBITORY ACTIVITY AGAINST SERINE PROTEASES, DERIVED HYBRID PEPTIDES THEREOF, AND USES THEREOF INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2023-12-28 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-20230416329-A1 A PEPTIDE WITH DISULFIDE BONDS AND INHIBITORY ACTIVITY AGAINST SERINE PROTEASES, DERIVED HYBRID PEPTIDES THEREOF, AND USES THEREOF VIP, SI, TMPRSS15 NPY4R 1616/4885NPY1R 1934/4885NPY2R 2570/4885

“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.