SCHEMBL25392198

SCHEMBL25392198

O=C(O)c1ccc(-c2cc(C3=C4C=CC(=N4)C(c4cc(-c5ccc(C(=O)O)cc5)cc(-c5ccc(C(=O)O)cc5)c4)=C4C=CC(=N4)C(c4cc(-c5ccc(C(=O)O)cc5)cc(-c5ccc(C(=O)O)cc5)c4)=C4C=CC(=N4)C(c4cc(-c5ccc(C(=O)O)cc5)cc(-c5ccc(C(=O)O)cc5)c4)=C4C=CC3=N4)cc(-c3ccc(C(=O)O)cc3)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.47
▸ RXRA P19793 7/20 0.46
▸ RXRB P28702 6/20 0.46
▸ RXRG P48443 2/20 0.42
▸ BCL2L1 Q07817 1/20 0.42
▸ BAD Q92934 1/20 0.42
▸ ERN1 O75460 2/20 0.41
▸ MKNK1 Q9BUB5 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ CA14 Q9ULX7 1/20 0.38

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
SCHEMBL17183610 0.88 TP53 (0.43) RXRARXRBBCL2L1BADERN1
SCHEMBL21768343 0.88 TP53 (0.43) RXRARXRBBCL2L1BADERN1
SCHEMBL483513 0.85 NPC1 (0.47) EGFRMKNK1MKNK2KDM4ETP53
SCHEMBL25394857 0.85 NPC1 (0.47) EGFRMKNK1MKNK2KDM4ETP53
SCHEMBL25395879 0.85 NPC1 (0.47) EGFRMKNK1MKNK2KDM4ETP53
SCHEMBL22463700 0.84 CA2 (0.52) EGFRRXRARXRBBCL2L1BAD
SCHEMBL25397077 0.83 TPMT (0.36) KDM4ELMNAHSD17B10TP53TSHR
SCHEMBL1977054 0.83 ALDH1A1 (0.53) RXRARXRBKDM4ETP53TSHR
SCHEMBL19718104 0.79 TSHR (0.42) EGFRRXRAERN1KDM4ELMNA
SCHEMBL25395982 0.77 KMO (0.51) RXRARXRBERN1KDM4ELMNA

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-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

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 EGFR 372/4885RXRA 4308/4885RXRB 4610/4885

“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.

Send feedback