SCHEMBL20701808

SCHEMBL20701808

CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)N1C(=O)N(C2CCCCC2)C[C@H]1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.41
KMT2A Q03164 2/20 0.41
CMA1 P23946 2/20 0.40
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40
CTSL P07711 2/20 0.39
CTSB P07858 1/20 0.38
CTSS P25774 1/20 0.38
REN P00797 1/20 0.38
CTSD P07339 1/20 0.38
KLK7 P49862 1/20 0.37
KLK5 Q9Y337 1/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
BCHE P06276 2/20 0.37
ACHE P22303 2/20 0.37
CACNA1F O60840 1/20 0.37
CACNA1D Q01668 1/20 0.37
CACNA1S Q13698 1/20 0.37
CACNA1C Q13936 1/20 0.37

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
SCHEMBL20701812 1.00 ACE (0.41) ACEKMT2ACMA1ITGB3ITGA2B
SCHEMBL20701811 1.00 ACE (0.41) ACEKMT2ACMA1ITGB3ITGA2B
SCHEMBL20986949 0.87 GZMB (0.38) KMT2ACMA1ITGB3ITGA2BREN
SCHEMBL20701553 0.86 CTSL (0.46) ACECMA1ITGB3ITGA2BCTSL
SCHEMBL20701559 0.86 CTSL (0.46) ACECMA1ITGB3ITGA2BCTSL
SCHEMBL20701557 0.86 CTSL (0.46) ACECMA1ITGB3ITGA2BCTSL
SCHEMBL20701563 0.86 CTSL (0.46) ACECMA1ITGB3ITGA2BCTSL
SCHEMBL18103810 0.80 ACE (0.42) ACEKMT2ACMA1CTSLCTSB
SCHEMBL18103807 0.80 ACE (0.42) ACEKMT2ACMA1CTSLCTSB
SCHEMBL17446707 0.78 CTSD (0.51) KMT2ACTSLCTSBCTSSREN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3186270-B1 CYCLIC UREA COMPOUNDS AS GRANZYME B INHIBITORS VIDA THERAPEUTICS INC (CA) 2020-02-19 EP disclosed
US-10537652-B2 Cyclic urea compounds as granzyme B inhibitors VIDA THERAPEUTICS INC. (CA) 2020-01-21 US disclosed
US-20190151484-A2 CYCLIC UREA COMPOUNDS AS GRANZYME B INHIBITORS VIDA THERAPEUTICS INC. (CA) 2019-05-23 US disclosed
US-20190038602-A1 GRANZYME B INHIBITOR FORMULATIONS AND METHODS FOR THE TREATMENT OF BURNS VIDA THERAPEUTICS, INC. (CA) 2019-02-07 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-20190038602-A1 GRANZYME B INHIBITOR FORMULATIONS AND METHODS FOR THE TREATMENT OF BURNS GZMB, CTSB, SERPINB1 ACE 1309/4885KMT2A 4848/4885CMA1 25/4885

“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.