SCHEMBL29910058

SCHEMBL29910058

CNS(=O)(=O)c1cccc(O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ TNNI3K Q59H18 4/20 0.49
▸ EGFR P00533 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ CYTH2 Q99418 1/20 0.47
▸ LMNA P02545 2/20 0.47
▸ PTBP1 P26599 1/20 0.47
▸ HSD17B2 P37059 3/20 0.46
▸ HSD17B1 P14061 2/20 0.46
▸ PKM P14618 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CA2 P00918 2/20 0.45
▸ MAPT P10636 1/20 0.44
▸ UQCRB P14927 1/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA3 P07451 1/20 0.44
▸ CA4 P22748 1/20 0.44
▸ CA6 P23280 1/20 0.44

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
SCHEMBL4945399 1.00 L3MBTL1 (0.52) L3MBTL1TNNI3KEGFRTSHRCYTH2
SCHEMBL13362241 0.89 HSD17B1 (0.56) L3MBTL1TNNI3KEGFRTSHRHSD17B2
SCHEMBL2242660 0.85 L3MBTL1 (0.61) L3MBTL1TNNI3KEGFRLMNAPTBP1
SCHEMBL27743877 0.82 CA2 (0.59) CYTH2LMNAHSD17B2HSD17B1PKM
SCHEMBL13614682 0.80 TSHR (0.52) L3MBTL1TNNI3KEGFRTSHRLMNA
SCHEMBL9866942 0.79 HTR2B (0.49) CYTH2HSD17B2HSD17B1PKM
SCHEMBL2543543 0.79 PKM (0.56) TSHRCYTH2PKMGAASMN1; SMN2
SCHEMBL29403896 0.79 ALDH1A1 (0.50) TSHRCYTH2LMNAHSD17B2HSD17B1
SCHEMBL8272569 0.78 TNNI3K (0.60) L3MBTL1TNNI3KEGFRLMNAPTBP1
SCHEMBL29547938 0.78 KMT2A (0.67) L3MBTL1TNNI3KEGFRLMNAGAA

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-20220267276-A1 NLRP MODULATORS NOVARTIS INFLAMMASOME RESEARCH, INC. 2022-08-25 — — 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-20220267276-A1 NLRP MODULATORS NLRP1, NRP1, NR4A3 L3MBTL1 4865/4885TNNI3K 2087/4885EGFR 3034/4885

“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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