SCHEMBL23559474

SCHEMBL23559474

Cc1cc(C(=O)OC(C)(C)C(F)(F)C(=O)O)ccc1I

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 2/20 0.40
▸ HTR7 P34969 1/20 0.32
▸ ELANE P08246 1/20 0.32
▸ ABCC9 O60706 2/20 0.32
▸ ABCC8 Q09428 2/20 0.32
▸ KCNJ11 Q14654 2/20 0.32
▸ KCNJ8 Q15842 2/20 0.32
▸ PPARD Q03181 2/20 0.31
▸ PPARA Q07869 2/20 0.31
▸ PPARG P37231 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ GABRG2 P18507 1/20 0.31
▸ GABRB3 P28472 1/20 0.31
▸ GABRA3 P34903 1/20 0.31
▸ GABRA2 P47869 1/20 0.31
▸ CES2 O00748 1/20 0.30
▸ CES1 P23141 1/20 0.30
▸ SLC7A5 Q01650 1/20 0.30
▸ ALDH1A1 P00352 2/20 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
SCHEMBL23559318 0.82 PDK1 (0.36) NOTUMELANEPPARDPPARAPPARG
SCHEMBL23559315 0.81 HTT (0.39) NOTUMELANEALDH1A1KMT2A
SCHEMBL23559559 0.81 TPMT (0.41) NOTUMELANEALDH1A1HSD17B10
SCHEMBL23559310 0.80 ESR1 (0.42) PPARGKMT2AESR1KDM4EHPGD
SCHEMBL23559563 0.79 TP53BP1 (0.39) MTORSLC7A5ALDH1A1HSD17B10
SCHEMBL23382488 0.77 CA12 (0.46) ELANEPPARAPPARGGABRA1GABRG2
SCHEMBL24361180 0.76 CA12 (0.47) ELANEALDH1A1KMT2AESR1
SCHEMBL24360817 0.76 TSHR (0.49) ELANECES1ALDH1A1KMT2AHSD17B10
SCHEMBL23559239 0.75 NOTUM (0.40) NOTUMHTR7ALDH1A1ESR1KDM4E
SCHEMBL24360878 0.75 CES2 (0.47) PPARAPPARGCES2CES1

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 NOTUM 576/4885HTR7 3989/4885ELANE 2738/4885

“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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