SCHEMBL25392157

SCHEMBL25392157

O=C(O)c1ccc(-c2cc(-c3ccc(C(=O)O)cc3)cc(-c3c4nc(c(-c5cc(-c6ccc(C(=O)O)cc6)cc(-c6ccc(C(=O)O)cc6)c5)c5ccc([nH]5)c(-c5cc(-c6ccc(C(=O)O)cc6)cc(-c6ccc(C(=O)O)cc6)c5)c5nc(c(-c6cc(-c7ccc(C(=O)O)cc7)cc(-c7ccc(C(=O)O)cc7)c6)c6ccc3[nH]6)C=C5)C=C4)c2)cc1

nearest known ligand 0.83

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYCS P99999 4/20 0.83
▸ TOP1 P11387 4/20 0.83
▸ ENPP2 Q13822 1/20 0.50
▸ GRIK1 P39086 1/20 0.48
▸ GRIK2 Q13002 1/20 0.48
▸ GRIK3 Q13003 1/20 0.48
▸ ABCG2 Q9UNQ0 1/20 0.47
▸ RXRA P19793 2/20 0.46
▸ RXRB P28702 2/20 0.46
▸ EGFR P00533 1/20 0.44
▸ TERT O14746 2/20 0.43

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
SCHEMBL12842181 0.92 CYCS (0.97) CYCSTOP1ENPP2GRIK1GRIK2
SCHEMBL29354037 0.91 TOP1 (1.00) CYCSTOP1ENPP2GRIK1GRIK2
SCHEMBL709532 0.91 TOP1 (1.00) CYCSTOP1ENPP2GRIK1GRIK2
SCHEMBL1497141 0.89 TOP1 (0.97) CYCSTOP1ENPP2GRIK1GRIK2
SCHEMBL31439152 0.89 TOP1 (0.97) CYCSTOP1ENPP2GRIK1GRIK2
SCHEMBL30928977 0.89 TOP1 (0.97) CYCSTOP1ENPP2GRIK1GRIK2
SCHEMBL17183606 0.89 TOP1 (0.97) CYCSTOP1ENPP2GRIK1GRIK2
SCHEMBL19640853 0.89 CYCS (1.00) CYCSTOP1ENPP2GRIK1GRIK2
SCHEMBL3047596 0.89 TOP1 (0.97) CYCSTOP1ENPP2GRIK1GRIK2
Hydrochloric Acid SCHEMBL17002623 0.89 TOP1 (0.97) CYCSTOP1ENPP2GRIK1GRIK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12546743-B2 Electrochemical sensor and related methods UNIVERSITY OF SOUTH FLORIDA (US) 2026-02-10 — — US disclosed
US-20230296554-A1 ELECTROCHEMICAL SENSOR AND RELATED METHODS UNIVERSITY OF SOUTH FLORIDA 2023-09-21 — — US disclosed
CN-110078931-B Organic frame material and application 浙江大学 2020-08-28 — — CN disclosed
CN-110078931-A A kind of organic framework materials and purposes 浙江大学 2019-08-02 — — CN 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-12546743-B2 Electrochemical sensor and related methods EPX, MUC1, EPCAM CYCS 2095/4885TOP1 4862/4885ENPP2 2359/4885

“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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