SCHEMBL9744259

SCHEMBL9744259

O=C(N[C@@H](Cc1ccc(O)c(OCc2ccccc2)c1)C(=O)OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.58
MBTPS1 Q14703 1/20 0.51
CTSL P07711 3/20 0.50
CTSB P07858 3/20 0.50
CTSS P25774 3/20 0.50
TACR1 P25103 2/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
CTSK P43235 2/20 0.49
ITGB3 P05106 4/20 0.48
ITGA2B P08514 4/20 0.48
ITGA4 P13612 1/20 0.48
ITGB7 P26010 1/20 0.48
ALDH1A1 P00352 1/20 0.48
ALOX15 P16050 1/20 0.48

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
SCHEMBL29774427 0.96 TYR (0.54) TYRCTSLCTSBCTSSTACR1
SCHEMBL25471796 0.96 TYR (0.54) TYRCTSLCTSBCTSSTACR1
SCHEMBL27406814 0.95 TYR (0.56) TYRCTSLCTSBCTSSTACR1
SCHEMBL25471793 0.95 TYR (0.56) TYRCTSLCTSBCTSSTACR1
SCHEMBL29838907 0.93 ITGB3 (0.56) TYRCTSLCTSBCTSSTACR1
SCHEMBL17685892 0.93 ITGB3 (0.56) TYRCTSLCTSBCTSSTACR1
SCHEMBL25471896 0.93 TYR (0.52) TYRCTSLCTSBCTSSTACR1
SCHEMBL25471783 0.91 HDAC8 (0.53) TYRCTSLCTSBCTSSTACR1
SCHEMBL27406816 0.91 TYR (0.50) TYRMBTPS1CTSLCTSBCTSS
SCHEMBL27406822 0.91 HDAC8 (0.53) TYRCTSLCTSBCTSSTACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240024338-A1 CARBIDOPA AND L-DOPA PRODRUGS AND METHODS OF USE ABBVIE INC (US) 2024-01-25 US disclosed
EP-4186510-A1 INTERMEDIATES AND PROCESS FOR PREPARING L-DOPA DIPHOSPHATE AbbVie Inc. (US) 2023-05-31 EP disclosed
US-20230106081-A1 METHODS OF TREATING PARKINSON'S DISEASE ABBVIE INC. 2023-04-06 US disclosed
US-20220153765-A1 METHODS OF TREATING PARKINSON'S DISEASE ABBVIE INC. 2022-05-19 US disclosed
EP-0309827-B1 L-DOPA DERIVATIVES OR THEIR ACID ADDITION SALTS, PROCESS FOR PRODUCING SAME AND THEIR USE BANYU PHARMACEUTICAL CO., LTD. (JP) 1992-01-02 EP disclosed
US-4966915-A L-dopa derivatives or their acid addition salts, process for producing same and their use BANYU PHARMACEUTICAL CO., LTD. (JP) 1990-10-30 US disclosed
EP-0309827-A1 L-Dopa derivatives or their acid addition salts, process for producing same and their use BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-04-05 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 (3 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-20220153765-A1 METHODS OF TREATING PARKINSON'S DISEASE SNCA, PARK7, COMT TYR 117/4885MBTPS1 3111/4885CTSL 394/4885
US-20230106081-A1 METHODS OF TREATING PARKINSON'S DISEASE SNCA, PARK7, COMT TYR 117/4885MBTPS1 3111/4885CTSL 394/4885
US-20240024338-A1 CARBIDOPA AND L-DOPA PRODRUGS AND METHODS OF USE COMT, SNCA, PARK7 TYR 277/4885MBTPS1 2784/4885CTSL 262/4885

“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.