SCHEMBL7890585

SCHEMBL7890585

C=CCOC(=O)[C@@H](NC(=O)[C@H](Cc1ccc2ccccc2n1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)C

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 11/20 0.46
▸ CASP7 P55210 6/20 0.46
▸ CASP1 P29466 2/20 0.46
▸ CASP9 P55211 2/20 0.46
▸ PRCP P42785 1/20 0.40

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
SCHEMBL16770356 0.84 CASP3 (0.46) CASP3CASP1
SCHEMBL29609769 0.82 CASP3 (0.55) CASP3
SCHEMBL6507462 0.80 MDM4 (0.53) CASP3
SCHEMBL6507453 0.80 MDM4 (0.53) CASP3
SCHEMBL29678995 0.80 MDM4 (0.53) CASP3
SCHEMBL7973193 0.79 PTPN1 (0.45) CASP3
SCHEMBL9962141 0.79 CASP3 (0.43) CASP3
SCHEMBL7969461 0.78 CASP3 (0.41) CASP3CASP7CASP1CASP9
SCHEMBL18781745 0.78 CASP3 (0.41) CASP3CASP7CASP1CASP9
SCHEMBL7968633 0.78 CASP3 (0.41) CASP3CASP7CASP1CASP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2288615-B1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF GENESIS TECH LTD (BB) 2017-06-21 — — EP disclosed
US-9045524-B2 Selective caspase inhibitors and uses thereof NOVAGENESIS FOUNDATION (CH) 2015-06-02 — — US disclosed
US-20150011458-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF NEW WORLD LABORATORIES INC. (CA) 2015-01-08 — — US disclosed
US-8791235-B2 Selective caspase inhibitors and uses thereof NOVAGENESIS FOUNDATION (CH) 2014-07-29 — — US disclosed
WO-2010133000-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF NEW WORLD LABORATORIES INC. (CA) 2010-11-25 — — WO disclosed
WO-2009140765-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF NEW WORLD LABORATORIES INC. (CA) 2009-11-26 — — 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-20150011458-A1 SELECTIVE CASPASE INHIBITORS AND USES THEREOF CASP3, CASP1, HTRA2 CASP3 1/4885CASP7 9/4885CASP1 2/4885

“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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