SCHEMBL24361017

SCHEMBL24361017

CC(C)(C)OC(=O)c1cc(I)ccc1OC(=O)C(F)(F)C(F)(F)C(F)(F)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ VCAM1 P19320 1/20 0.38
▸ GABRG2 P18507 3/20 0.34
▸ GABRB3 P28472 3/20 0.34
▸ GABRA5 P31644 3/20 0.34
▸ GABRA1 P14867 2/20 0.34
▸ GABRA3 P34903 2/20 0.34
▸ GABRA2 P47869 2/20 0.34
▸ GABRA6 Q16445 1/20 0.32
▸ ELANE P08246 2/20 0.31
▸ RXRA P19793 2/20 0.30
▸ NR1H2 P55055 2/20 0.30
▸ NR1H3 Q13133 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
SCHEMBL24360784 0.93 GABRG2 (0.36) VCAM1GABRG2GABRB3GABRA5GABRA1
SCHEMBL24360877 0.83 ELANE (0.46) VCAM1ELANE
SCHEMBL24360871 0.82 GABRA1 (0.39) VCAM1GABRG2GABRB3GABRA5GABRA1
SCHEMBL24361018 0.81 VCAM1 (0.43) VCAM1
SCHEMBL24361103 0.77 MAP2K2 (0.38) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL12903047 0.75 GABRG2 (0.42) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL24360786 0.75 ELANE (0.48) ELANE
SCHEMBL24360787 0.73 VCAM1 (0.35) VCAM1
SCHEMBL12942077 0.71 GABRG2 (0.42) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL24360875 0.70 VCAM1 (0.39) VCAM1ELANERXRA

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 VCAM1 3719/4885GABRG2 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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