SCHEMBL20691726

SCHEMBL20691726

CCC(I)C(=O)OCCc1cccc2c(O)cccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 1/20 0.41
▸ IAPP P10997 4/20 0.38
▸ CDC25B P30305 2/20 0.37
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA7 P43166 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CA14 Q9ULX7 1/20 0.36
▸ CDYL Q9Y232 1/20 0.36
▸ AKR1B10 O60218 1/20 0.35
▸ AKR1B1 P15121 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ BID P55957 3/20 0.33
▸ MCL1 Q07820 3/20 0.33
▸ BCL2L1 Q07817 2/20 0.33
▸ BAK1 Q16611 2/20 0.33
▸ KAT8 Q9H7Z6 2/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33

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
SCHEMBL18671831 0.86 CDC25B (0.39) IAPPCDC25BCA12CA1CA2
SCHEMBL20691725 0.83 IDO1 (0.42) CDC25BKDM4E
SCHEMBL20691727 0.83 CDC25B (0.47) CDC25BCA12CA1CA2CA7
SCHEMBL18671828 0.78 IDO1 (0.40) CDC25BKDM4EEP300
SCHEMBL20215425 0.76 TYR (0.36) TYRIAPPCDC25BCA12CA1
SCHEMBL18400983 0.76 TYR (0.40) TYRIAPPCDC25BCA12CA1
SCHEMBL18671901 0.76 ESR1 (0.50) CDC25BCA12CA1CA2CA7
SCHEMBL14461688 0.76 TYR (0.38) TYRIAPPCDC25BCA12CA1
SCHEMBL10040373 0.75 THRB (0.41) TYRIAPPCDC25BCA12CA1
SCHEMBL18697316 0.73 CYBB (0.37) TYRIAPPCDC25BCA12CA1

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-20190033716-A1 SULFONIUM SALT, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-01-31 — — 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-20190033716-A1 SULFONIUM SALT, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SMC4, SMCHD1, SMC3 TYR 3437/4885IAPP 3658/4885CDC25B 3741/4885

“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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