SCHEMBL29696622

SCHEMBL29696622

CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCC[C@H]1C(=O)OC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 1/20 0.49
▸ TLR2 O60603 2/20 0.46
▸ TLR1 Q15399 1/20 0.46
▸ ITGB3 P05106 1/20 0.45
▸ ITGA2B P08514 1/20 0.45
▸ MDM2 Q00987 2/20 0.43
▸ KMT2A Q03164 1/20 0.41
▸ MDM4 O15151 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ F2 P00734 1/20 0.40
▸ PRSS1 P07477 1/20 0.40
▸ ACE P12821 1/20 0.39
▸ KLK5 Q9Y337 1/20 0.39
▸ CMA1 P23946 1/20 0.38

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
SCHEMBL29696666 0.92 PRCP (0.43) PRCPTLR2TLR1ITGB3ITGA2B
SCHEMBL15960070 0.91 PRCP (0.51) PRCPTLR2TLR1ITGB3ITGA2B
SCHEMBL30640764 0.91 PRCP (0.51) PRCPTLR2TLR1ITGB3ITGA2B
SCHEMBL29696668 0.91 PRCP (0.51) PRCPTLR2TLR1ITGB3ITGA2B
SCHEMBL24580348 0.89 PRCP (0.42) PRCPTLR2TLR1ITGB3ITGA2B
SCHEMBL13035054 0.88 PRCP (0.51) PRCPTLR2TLR1ITGB3ITGA2B
SCHEMBL13035830 0.88 PRCP (0.51) PRCPTLR2TLR1ITGB3ITGA2B
SCHEMBL24580344 0.85 PRCP (0.51) PRCPTLR2TLR1ITGB3ITGA2B
Hydrochloric Acid SCHEMBL29445800 0.84 ELANE (0.46) PRCPTLR2TLR1ITGB3ITGA2B
SCHEMBL29696683 0.84 PRCP (0.46) PRCPMDM4TP53F2PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124517-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-04-18 — — US disclosed
EP-4269422-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-01 — — EP disclosed
WO-2022138891-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE 中外製薬株式会社 2022-06-30 — — 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-20240124517-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE VIP, NPEPPS, ANPEP PRCP 127/4885TLR2 3384/4885TLR1 3326/4885

“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.

Send feedback