SCHEMBL14067668

SCHEMBL14067668

CC(C)CCNC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 14/20 0.77
▸ CTSS P25774 6/20 0.74
▸ CTSL P07711 2/20 0.74
▸ CTSB P07858 1/20 0.74
▸ CAPN1 P07384 1/20 0.71
▸ CAPN2 P17655 1/20 0.71
▸ CA5A P35218 1/20 0.67
▸ CA1 P00915 1/20 0.65

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
SCHEMBL7286596 0.92 CTSK (0.67) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL9115066 0.91 CAPN1 (0.80) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL29052552 0.90 CTSK (0.77) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL29052549 0.90 CTSK (0.77) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL6358735 0.89 CTSK (0.69) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL22034395 0.88 NMBR (0.63) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL22034396 0.88 NMBR (0.63) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL5443106 0.87 CAPN1 (0.74) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL7183327 0.87 CTSK (0.73) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL6361583 0.87 CTSK (0.76) CTSKCTSSCTSLCTSBCAPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080227806-A1 Novel Drugs for Dementia AMERICAN LIFE SCIENCE PHARMACEUTICALS (US) 2008-09-18 — — US disclosed
US-20080227806-A1 Novel Drugs for Dementia AMERICAN LIFE SCIENCE PHARMACEUTICALS (US) 2008-09-18 — — US disclosed
WO-2007038772-A1 NOVEL DRUGS FOR DEMENTIA AMERICAN LIFE SCIENCE PHARMACEUTICALS (US) 2007-04-05 — — 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-20080227806-A1 Novel Drugs for Dementia CTSS, PRSS1, CBS CTSK 114/4885CTSS 1/4885CTSL 37/4885

“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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