SCHEMBL23559561

SCHEMBL23559561

CC(C)(OC(=O)c1ccc(I)cc1I)C(F)(F)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GABRG2 P18507 2/20 0.32
▸ GABRB3 P28472 2/20 0.32
▸ GABRA5 P31644 2/20 0.32
▸ GABRA1 P14867 1/20 0.32
▸ GABRA3 P34903 1/20 0.32
▸ GABRA2 P47869 1/20 0.32
▸ CFTR P13569 2/20 0.31

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
SCHEMBL23559472 0.86 MAP2K1 (0.36) —
SCHEMBL23559469 0.86 CES2 (0.36) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL23559319 0.84 CA12 (0.36) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL23559314 0.84 PTPN1 (0.34) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL23559471 0.84 NOTUM (0.35) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL23559564 0.83 SOS1 (0.33) CFTR
SCHEMBL23559560 0.82 PTPN2 (0.40) —
SCHEMBL23559473 0.82 TTR (0.39) CFTR
SCHEMBL23559562 0.81 TTR (0.31) CFTR
SCHEMBL23559559 0.79 TPMT (0.41) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210188770-A1 ONIUM SALT COMPOUND, CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-06-24 — — 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-20210188770-A1 ONIUM SALT COMPOUND, CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SLC6A5, LIFR, SLC6A9 GABRG2 2350/4885GABRB3 2770/4885GABRA5 1719/4885

“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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