SCHEMBL17799165

SCHEMBL17799165

O=C(CO)C[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CPA1 P15085 7/20 0.72
▸ CPA3 P15088 3/20 0.70
▸ CPB1 P15086 1/20 0.70
▸ CPB2 Q96IY4 1/20 0.70
▸ CYP1A2 P05177 1/20 0.68
▸ MME P08473 3/20 0.65
▸ FOLH1 Q04609 2/20 0.65
▸ SLC1A3 P43003 1/20 0.59
▸ SLC1A2 P43004 1/20 0.59
▸ SLC1A1 P43005 1/20 0.59
▸ ANPEP P15144 1/20 0.56
▸ RNPEP Q9H4A4 1/20 0.56
▸ DNPEP Q9ULA0 1/20 0.56

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
SCHEMBL6469019 0.87 CPA1 (0.70) CPA1CPA3CPB1CPB2CYP1A2
SCHEMBL17948789 0.87 CPA1 (0.70) CPA1CPA3CPB1CPB2CYP1A2
SCHEMBL1177225 0.87 CPA1 (0.70) CPA1CPA3CPB1CPB2CYP1A2
SCHEMBL28484063 0.87 CPA1 (0.70) CPA1CPA3CPB1CPB2CYP1A2
Bromide SCHEMBL1177352 0.86 CPA1 (0.68) CPA1CPA3CPB1CPB2CYP1A2
SCHEMBL28102506 0.84 CPA1 (1.00) CPA1CPA3CPB1CPB2CYP1A2
SCHEMBL7286643 0.84 CPA1 (0.70) CPA1CPA3CPB1CPB2CYP1A2
SCHEMBL10076047 0.84 CPA1 (0.70) CPA1CPA3CPB1CPB2CYP1A2
SCHEMBL7540821 0.83 CPA1 (0.72) CPA1CPA3CPB1CPB2CYP1A2
SCHEMBL9029155 0.83 CPA1 (0.72) CPA1CPA3CPB1CPB2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200087648-A1 PARKIN LIGASE ACTIVATION METHODS AND COMPOSITIONS NYSNOBIO IRELAND DAC (IE) 2020-03-19 — — US disclosed
US-10155936-B2 Parkin ligase activation methods and compositions An2H Discovery Limited (IE) 2018-12-18 — — US disclosed
US-20160160205-A1 PARKIN LIGASE ACTIVATION METHODS AND COMPOSITIONS An2H Discovery Limited (IE) 2016-06-09 — — US disclosed
US-20160160205-A1 PARKIN LIGASE ACTIVATION METHODS AND COMPOSITIONS An2H Discovery Limited (IE) 2016-06-09 — — US disclosed
US-20160160205-A1 PARKIN LIGASE ACTIVATION METHODS AND COMPOSITIONS An2H Discovery Limited (IE) 2016-06-09 — — US 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-10155936-B2 Parkin ligase activation methods and compositions PINK1, XIAP, STUB1 CPA1 3802/4885CPA3 4290/4885CPB1 2398/4885
US-20200087648-A1 PARKIN LIGASE ACTIVATION METHODS AND COMPOSITIONS PINK1, XIAP, STUB1 CPA1 3802/4885CPA3 4290/4885CPB1 2398/4885
US-20160160205-A1 PARKIN LIGASE ACTIVATION METHODS AND COMPOSITIONS PINK1, XIAP, STUB1 CPA1 3802/4885CPA3 4290/4885CPB1 2398/4885

“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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