SCHEMBL13390885

SCHEMBL13390885

CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(C(=O)N[C@@H](Cc1ccccc1)[C@H](O)[C@@H](O)[C@@H]1CCCN1C(=O)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(C)=O)C(C)C)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DPP3 Q9NY33 5/20 0.49
▸ REN P00797 1/20 0.47

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
SCHEMBL13379920 0.89 POLB (0.50) DPP3
SCHEMBL24245857 0.81 DPP3 (0.54) DPP3
SCHEMBL22753494 0.77 DPP3 (0.51) DPP3
SCHEMBL10036414 0.77 DPP3 (0.58) DPP3REN
SCHEMBL13018973 0.76 DPP3 (0.55) DPP3
SCHEMBL13950953 0.76 DPP3 (0.55) DPP3
SCHEMBL14420050 0.74 CTSD (0.47) REN
SCHEMBL29993706 0.73 DPP3 (0.68) DPP3REN
SCHEMBL30091409 0.72 REN (0.57) REN
SCHEMBL29572021 0.72 DPP3 (0.71) DPP3REN

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-7691818-B2 Peptidomimetic inhibitors of retroviral proteases and their use as antivirals Universita' Degli Studi Di Treiste (IT) 2010-04-06 — — US disclosed
US-20070207968-A1 Peptidomimetic Inhibitors Of Retroviral Proteases And Their Use As Antivirals UNIVERSITA' DEGLI STUDI DI TRIESTE (IT) 2007-09-06 — — 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-20070207968-A1 Peptidomimetic Inhibitors Of Retroviral Proteases And Their Use As Antivirals PREP, PEPD, DNPEP DPP3 14/4885REN 872/4885

“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