SCHEMBL13035830

SCHEMBL13035830

C=CCOC(=O)NCCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCC[C@H]1C(=O)OC(c1ccccc1)(c1ccccc1)c1ccc(C)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 1/20 0.51
▸ MDM2 Q00987 2/20 0.40
▸ TLR2 O60603 1/20 0.39
▸ TLR1 Q15399 1/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ TGM2 P21980 9/20 0.38
▸ F13A1 P00488 2/20 0.38
▸ TGM1 P22735 2/20 0.38
▸ ITGB3 P05106 1/20 0.37
▸ ITGA2B P08514 1/20 0.37
▸ TGM6 O95932 1/20 0.36
▸ MDM4 O15151 1/20 0.36
▸ TP53 P04637 1/20 0.36

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
SCHEMBL13035054 1.00 PRCP (0.51) PRCPMDM2TLR2TLR1KMT2A
SCHEMBL29696622 0.88 PRCP (0.49) PRCPMDM2TLR2TLR1KMT2A
SCHEMBL13034905 0.82 ACE (0.49) KMT2AITGB3ITGA2B
SCHEMBL29696666 0.81 PRCP (0.43) PRCPMDM2TLR2TLR1KMT2A
SCHEMBL13035062 0.80 ACE (0.44) PRCP
SCHEMBL30640764 0.79 PRCP (0.51) PRCPMDM2TLR2TLR1KMT2A
SCHEMBL29696668 0.79 PRCP (0.51) PRCPMDM2TLR2TLR1KMT2A
SCHEMBL15960070 0.79 PRCP (0.51) PRCPMDM2TLR2TLR1KMT2A
SCHEMBL21838230 0.79 PRCP (0.49) PRCPMDM4TP53
SCHEMBL21838231 0.79 PRCP (0.49) PRCPMDM4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759295-B2 Peptide-peptidase inhibitor conjugates and methods of using same AMYLIN PHARMACEUTICALS, LLC (US) 2014-06-24 — — US disclosed
US-20100292172-A1 Peptide-Peptidase Inhibitor Conjugates and Methods of Using Same AMYLIN PHARMACEUTICALS, INC. (US) 2010-11-18 — — 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-20100292172-A1 Peptide-Peptidase Inhibitor Conjugates and Methods of Using Same DNPEP, PEPD, VIP PRCP 23/4885MDM2 3204/4885TLR2 4743/4885

“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