SCHEMBL9925691

SCHEMBL9925691

CCC(C)C(NC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC21)C(=O)NC(CCC(=O)O)C(=O)N1CCCC1C(=O)NC(CC(=O)O)P(=O)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PLG P00747 2/20 0.62
▸ PRSS1 P07477 2/20 0.62
▸ PRSS2 P07478 2/20 0.62
▸ PRSS3 P35030 2/20 0.62
▸ TPSAB1 Q15661 2/20 0.62
▸ F2 P00734 2/20 0.62
▸ PIN1 Q13526 1/20 0.48
▸ CASP3 P42574 2/20 0.47
▸ CASP1 P29466 1/20 0.47
▸ CASP2 P42575 1/20 0.47
▸ CASP7 P55210 1/20 0.47
▸ CASP8 Q14790 1/20 0.47
▸ MAFG O15525 1/20 0.46
▸ FOLH1 Q04609 7/20 0.44
▸ XIAP P98170 1/20 0.41
▸ BIRC3 Q13489 1/20 0.41
▸ LCK P06239 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ CAPN1 P07384 2/20 0.41

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
SCHEMBL15397822 0.80 PLG (0.64) PLGPRSS1PRSS2PRSS3TPSAB1
SCHEMBL15397969 0.80 PLG (0.64) PLGPRSS1PRSS2PRSS3TPSAB1
SCHEMBL14521652 0.79 ELANE (0.44) PLGPRSS1PRSS2PRSS3TPSAB1
SCHEMBL15397928 0.77 PLG (0.56) PLGPRSS1PRSS2PRSS3TPSAB1
SCHEMBL7113668 0.76 FOLH1 (0.50) PLGPRSS1PRSS2PRSS3TPSAB1
SCHEMBL18103817 0.75 CASP3 (0.48) PLGPRSS1PRSS2PRSS3TPSAB1
SCHEMBL18116208 0.75 CASP3 (0.48) PLGPRSS1PRSS2PRSS3TPSAB1
SCHEMBL15397835 0.74 PRSS1 (0.56) PLGPRSS1PRSS2PRSS3TPSAB1
SCHEMBL15397856 0.74 PRSS1 (0.56) PLGPRSS1PRSS2PRSS3TPSAB1
SCHEMBL15397891 0.73 PLG (0.55) PLGPRSS1PRSS2PRSS3TPSAB1

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-20140056964-A1 GRANZYME B INHIBITOR COMPOSITIONS, METHODS AND USES FOR PROMOTING WOUND HEALING THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2014-02-27 — — US disclosed
WO-2012076985-A2 GRANZYME B INHIBITOR COMPOSITIONS, METHODS AND USES FOR PROMOTING WOUND HEALING THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-06-14 — — 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-20140056964-A1 GRANZYME B INHIBITOR COMPOSITIONS, METHODS AND USES FOR PROMOTING WOUND HEALING GZMB, PRF1, SERPINB1 PLG 134/4885PRSS1 267/4885PRSS2 369/4885

“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.

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