SCHEMBL21486560

SCHEMBL21486560

CC(C)(C)[C@H](NC(=O)[C@H](CCC(=O)C(N)=O)NC(=O)c1ccncc1C(=O)O)C(=O)N1CC(=O)C[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(N)=O)C1CCCCC1)C1CCCCC1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 20/20 0.82
TGM2 P21980 20/20 0.82
TGM6 O95932 1/20 0.80
F13B P05160 1/20 0.80
TGM1 P22735 1/20 0.80
TGM3 Q08188 1/20 0.80

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
SCHEMBL21486561 1.00 F13A1 (0.82) F13A1TGM2TGM6F13BTGM1
SCHEMBL20338785 0.95 F13A1 (0.80) F13A1TGM2TGM6F13BTGM1
SCHEMBL20338789 0.95 F13A1 (0.80) F13A1TGM2TGM6F13BTGM1
SCHEMBL21516583 0.95 F13A1 (0.78) F13A1TGM2TGM6F13BTGM1
SCHEMBL20338844 0.95 F13A1 (0.78) F13A1TGM2TGM6F13BTGM1
SCHEMBL20338737 0.95 F13A1 (0.78) F13A1TGM2TGM6F13BTGM1
SCHEMBL20338732 0.95 F13A1 (0.78) F13A1TGM2TGM6F13BTGM1
SCHEMBL20338806 0.94 F13A1 (0.77) F13A1TGM2TGM6F13BTGM1
SCHEMBL20338799 0.94 F13A1 (0.77) F13A1TGM2TGM6F13BTGM1
SCHEMBL20338871 0.92 F13A1 (0.74) F13A1TGM2TGM6F13BTGM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3405477-B1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2023-06-07 EP claimed
US-11072634-B2 Inhibitors of transglutaminases ZEDIRA GMBH (DE) 2021-07-27 US claimed
EP-3405477-B1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2023-06-07 EP disclosed
US-11072634-B2 Inhibitors of transglutaminases ZEDIRA GMBH (DE) 2021-07-27 US disclosed
US-20190322700-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2019-10-24 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 (2 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-20190322700-A1 INHIBITORS OF TRANSGLUTAMINASES TGM2, TGM3, TGM1 F13A1 209/4885TGM2 1/4885TGM6 4/4885
US-11072634-B2 Inhibitors of transglutaminases TGM2, TGM3, TGM1 F13A1 209/4885TGM2 1/4885TGM6 4/4885

“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.