SCHEMBL25518532

SCHEMBL25518532

Cc1cc(C)c(S(=O)(=O)Nc2ccccc2)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ MAPT P10636 1/20 0.48
▸ SLC22A12 Q96S37 1/20 0.47
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ BRD4 O60885 1/20 0.46
▸ BRD2 P25440 1/20 0.46
▸ BRD3 Q15059 1/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ HSD17B2 P37059 1/20 0.46
▸ GAA P10253 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ IDH1 O75874 3/20 0.45

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
SCHEMBL23833645 0.85 CYP3A4 (0.49) CYP3A4CYP2C19ALDH1A1TP53TDP1
SCHEMBL23833599 0.82 ALDH1A1 (0.48) CYP3A4CYP2C19ALDH1A1TP53TDP1
SCHEMBL25522424 0.81 CYP3A4 (0.46) CYP3A4CYP2C19ALDH1A1TP53TDP1
SCHEMBL4365231 0.80 CYP3A4 (0.68) CYP3A4CYP2C19ALDH1A1MAPTCA12
SCHEMBL633994 0.74 ALDH1A1 (0.68) CYP3A4CYP2C19ALDH1A1TP53TDP1
SCHEMBL16455751 0.73 ALDH1A1 (0.45) ALDH1A1MAPTBRD4BRD2BRD3
SCHEMBL3842083 0.73 KMT2A (0.56) CYP3A4CYP2C19ALDH1A1TP53TDP1
SCHEMBL7822430 0.73 KMT2A (0.54) CYP3A4CYP2C19ALDH1A1TP53TDP1
SCHEMBL16139760 0.73 ALDH1A1 (0.56) CYP3A4ALDH1A1MAPTCA12CA1
SCHEMBL30925472 0.73 SLC40A1 (0.69) ALDH1A1TDP1MAPTKMT2AMEN1

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-20230159489-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND USE AKEBIA THERAPEUTICS, INC. (US) 2023-05-25 — — 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-20230159489-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND USE HIF1AN, EGLN3, PHF20 CYP3A4 3938/4885CYP2C19 3644/4885ALDH1A1 963/4885

“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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