SCHEMBL27132012

SCHEMBL27132012

CC(C)CC(NC(=O)OCc1ccccc1)C(=O)NC(Cc1ccc(O)c(OCc2ccccc2)c1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 2/20 0.60
CTSK P43235 9/20 0.57
CTSL P07711 8/20 0.54
CTSS P25774 3/20 0.54
CTSB P07858 5/20 0.54

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
SCHEMBL27001675 1.00 CAPN1 (0.60) CAPN1CTSKCTSLCTSSCTSB
SCHEMBL27406798 0.94 CAPN1 (0.58) CAPN1CTSKCTSLCTSSCTSB
SCHEMBL28806164 0.92 ITGB3 (0.53) CTSKCTSLCTSSCTSB
SCHEMBL28806163 0.92 ITGB3 (0.53) CTSKCTSLCTSSCTSB
SCHEMBL17685892 0.90 ITGB3 (0.56) CTSLCTSSCTSB
SCHEMBL29838907 0.90 ITGB3 (0.56) CTSLCTSSCTSB
SCHEMBL2928061 0.86 CAPN1 (0.67) CAPN1CTSKCTSLCTSSCTSB
SCHEMBL25471796 0.86 TYR (0.54) CTSKCTSLCTSSCTSB
SCHEMBL29774427 0.86 TYR (0.54) CTSKCTSLCTSSCTSB
SCHEMBL14148469 0.86 CAPN1 (0.72) CAPN1CTSKCTSLCTSSCTSB

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-20240207410-A1 STABILIZED LIQUID COMPOSITIONS COMPRISING A LEVODOPA-TYROSINE CONJUGATE AND USES THEREOF NEURODERM, LTD. (IL) 2024-06-27 US disclosed
EP-4305049-A1 STABILIZED LIQUID COMPOSITIONS COMPRISING A LEVODOPA-TYROSINE CONJUGATE AND USES THEREOF Neuroderm Ltd (IL) 2024-01-17 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-20240207410-A1 STABILIZED LIQUID COMPOSITIONS COMPRISING A LEVODOPA-TYROSINE CONJUGATE AND USES THEREOF COMT, TH, DDT CAPN1 3542/4885CTSK 1464/4885CTSL 1074/4885

“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.