SCHEMBL21514830

SCHEMBL21514830

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 20/20 1.00
TGM2 P21980 20/20 1.00
TGM6 O95932 1/20 0.90
F13B P05160 1/20 0.90
TGM1 P22735 1/20 0.90
TGM3 Q08188 1/20 0.90

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
SCHEMBL21510596 0.98 F13A1 (0.95) F13A1TGM2TGM6F13BTGM1
SCHEMBL21510595 0.96 F13A1 (1.00) F13A1TGM2TGM6F13BTGM1
SCHEMBL21510601 0.95 TGM2 (0.91) F13A1TGM2TGM6F13BTGM1
SCHEMBL21510597 0.95 F13A1 (1.00) F13A1TGM2TGM6F13BTGM1
SCHEMBL21510939 0.95 F13A1 (1.00) F13A1TGM2TGM6F13BTGM1
SCHEMBL21510600 0.94 F13A1 (0.95) F13A1TGM2TGM6F13BTGM1
SCHEMBL21510943 0.93 F13A1 (0.95) F13A1TGM2TGM6F13BTGM1
SCHEMBL21510937 0.93 F13A1 (0.96) F13A1TGM2TGM6F13BTGM1
SCHEMBL23371658 0.92 F13A1 (0.84) F13A1TGM2TGM6F13BTGM1
SCHEMBL21514853 0.91 TGM2 (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210147478-A1 INHIBITORS OF BLOOD COAGULATION FACTOR XIII ZEDIRA GMBH (DE) 2021-05-20 US disclosed
WO-2019202052-A1 INHIBITORS OF BLOOD COAGULATION FACTOR XIII ZEDIRA GMBH (DE) 2019-10-24 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-20210147478-A1 INHIBITORS OF BLOOD COAGULATION FACTOR XIII TFPI, F11, F13B F13A1 8/4885TGM2 383/4885TGM6 355/4885

“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.