SCHEMBL334446

SCHEMBL334446

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)Cc1ccccc1)C(=O)N[C@H](CNC(=O)/C=C/c1ccccc1)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 16/20 0.48
NPY1R P25929 10/20 0.48
NPY5R Q15761 9/20 0.48
NPY2R P49146 6/20 0.48
ITGB1 P05556 1/20 0.43
ITGA4 P13612 1/20 0.43
KISS1R Q969F8 1/20 0.42
CTSB P07858 1/20 0.41

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
SCHEMBL13389959 1.00 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RITGB1
SCHEMBL13389975 1.00 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RITGB1
SCHEMBL335531 0.95 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2RITGB1
SCHEMBL13390056 0.95 ITGB1 (0.44) NPY4RNPY1RNPY5RNPY2RITGB1
SCHEMBL334075 0.92 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL335529 0.92 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL335647 0.91 KISS1R (0.45) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL334323 0.90 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2RITGB1
SCHEMBL13181460 0.89 ITGB1 (0.41) NPY4RNPY1RNPY5RNPY2RITGB1
SCHEMBL334024 0.89 PSMB1 (0.49) NPY4RNPY1RCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097582-B2 Peptide derivatives useful as antimicrobial agents and for treating wounds NEOBIOTICS AB (SE) 2012-01-17 US disclosed
US-8097582-B2 Peptide derivatives useful as antimicrobial agents and for treating wounds NEOBIOTICS AB (SE) 2012-01-17 US disclosed
US-8097582-B2 Peptide derivatives useful as antimicrobial agents and for treating wounds NEOBIOTICS AB (SE) 2012-01-17 US disclosed
US-20090118198-A1 NOVEL PEPTIDE DERIVATIVES USEFUL AS ANTIMICROBIAL AGENTS FOR TREATING WOUNDS ZULA DIAGNOSTICS AB (SE) 2009-05-07 US disclosed
US-20090118198-A1 NOVEL PEPTIDE DERIVATIVES USEFUL AS ANTIMICROBIAL AGENTS FOR TREATING WOUNDS ZULA DIAGNOSTICS AB (SE) 2009-05-07 US disclosed
US-20090118198-A1 NOVEL PEPTIDE DERIVATIVES USEFUL AS ANTIMICROBIAL AGENTS FOR TREATING WOUNDS ZULA DIAGNOSTICS AB (SE) 2009-05-07 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-20090118198-A1 NOVEL PEPTIDE DERIVATIVES USEFUL AS ANTIMICROBIAL AGENTS FOR TREATING WOUNDS VIP, NGLY1, ARG1 NPY4R 488/4885NPY1R 315/4885NPY5R 716/4885

“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.