SCHEMBL19015779

SCHEMBL19015779

CC(C)[C@H](NC(=O)C(Cc1ccc2ccccc2n1)NC(=O)[C@H](CC(=O)O)NC(=O)OCc1ccccc1)C(=O)N[C@H](/C=C/S(=O)(=O)Oc1ccccc1)CC(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 19/20 1.00
CASP7 P55210 13/20 1.00
CASP1 P29466 8/20 1.00
CASP9 P55211 4/20 1.00
CASP4 P49662 1/20 0.59

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
SCHEMBL9961945 1.00 CASP3 (1.00) CASP3CASP7CASP1CASP9CASP4
SCHEMBL18782319 0.95 CASP3 (0.90) CASP3CASP7CASP1CASP9CASP4
SCHEMBL16376133 0.92 CASP3 (1.00) CASP3CASP7CASP1CASP9CASP4
SCHEMBL7888498 0.92 CASP3 (1.00) CASP3CASP7CASP1CASP9CASP4
SCHEMBL18782029 0.92 CASP3 (1.00) CASP3CASP7CASP1CASP9CASP4
SCHEMBL9961954 0.92 CASP3 (1.00) CASP3CASP7CASP1CASP9CASP4
SCHEMBL16377056 0.91 CASP3 (1.00) CASP3CASP7CASP1CASP9CASP4
SCHEMBL9961937 0.91 CASP3 (1.00) CASP3CASP7CASP1CASP9CASP4
SCHEMBL9961957 0.91 CASP3 (1.00) CASP3CASP7CASP1CASP9CASP4
SCHEMBL7970335 0.91 CASP3 (0.83) CASP3CASP7CASP1CASP9CASP4

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-10167313-B2 Selective caspase inhibitors and uses thereof GENESIS TECHNOLOGIES LIMITED (BB) 2019-01-01 US disclosed
EP-2288615-B1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF GENESIS TECH LTD (BB) 2017-06-21 EP 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-10167313-B2 Selective caspase inhibitors and uses thereof CASP1, CASP3, CASP5 CASP3 2/4885CASP7 7/4885CASP1 1/4885

“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.