SCHEMBL24360871

SCHEMBL24360871

O=C(OCC(F)(F)F)c1cc(I)ccc1OC(=O)C(F)(F)C(F)(F)C(F)(F)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 1/20 0.39
▸ GABRG2 P18507 1/20 0.39
▸ GABRB3 P28472 1/20 0.39
▸ GABRA5 P31644 1/20 0.39
▸ GABRA3 P34903 1/20 0.39
▸ GABRA2 P47869 1/20 0.39
▸ GABRA4 P48169 1/20 0.39
▸ GABRA6 Q16445 1/20 0.39
▸ VCAM1 P19320 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ F2 P00734 1/20 0.32
▸ PLAU P00749 1/20 0.32
▸ ELANE P08246 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL24360869 0.83 KDM4E (0.40) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL24361017 0.82 VCAM1 (0.38) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL24360870 0.81 VCAM1 (0.38) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL24361103 0.81 MAP2K2 (0.38) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL23518968 0.79 GABRA1 (0.42) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL24361101 0.75 KDM4E (0.41) KDM4ETSHRNPSR1TDP1L3MBTL1
SCHEMBL24360784 0.75 GABRG2 (0.36) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL24361105 0.74 GABRA1 (0.33) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL24360875 0.70 VCAM1 (0.39) VCAM1ELANE
SCHEMBL23559357 0.67 CA12 (0.41) GABRA1GABRG2GABRB3GABRA5GABRA3

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-20220127225-A1 ONIUM SALT, CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-04-28 — — 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-20220127225-A1 ONIUM SALT, CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS CACNA1F, SLC6A5, IDUA GABRA1 2599/4885GABRG2 2792/4885GABRB3 3239/4885

“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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