SCHEMBL20400392

SCHEMBL20400392

CN1CCn2ncc(S(N)(=O)=O)c2C1=O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 1/20 0.48
▸ CA12 O43570 3/20 0.33
▸ CA1 P00915 3/20 0.33
▸ CA2 P00918 3/20 0.33
▸ CA9 Q16790 3/20 0.33
▸ ALOX5 P09917 2/20 0.31
▸ ALOX5AP P20292 2/20 0.31
▸ FEN1 P39748 2/20 0.31
▸ CA7 P43166 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
SCHEMBL29888929 0.83 NLRP3 (0.47) NLRP3ALOX5ALOX5APFEN1
SCHEMBL20400046 0.77 NLRP3 (0.39) NLRP3ALOX5ALOX5APFEN1
Hydrochloric Acid SCHEMBL18209909 0.76 NLRP3 (0.38) NLRP3ALOX5ALOX5APFEN1
SCHEMBL20939381 0.75 NLRP3 (0.42) NLRP3ALOX5ALOX5APFEN1
SCHEMBL22021007 0.74 NLRP3 (0.40) NLRP3ALOX5ALOX5APFEN1
SCHEMBL20400002 0.72 CDC7 (0.33) CA12CA1CA2CA9ALOX5
SCHEMBL24978765 0.71 NLRP3 (0.37) NLRP3ALOX5ALOX5APFEN1
SCHEMBL20828220 0.71 ALOX5 (0.41) NLRP3ALOX5ALOX5APFEN1
SCHEMBL18215107 0.70 ALOX5 (0.40) NLRP3ALOX5ALOX5APFEN1
SCHEMBL28396680 0.69 NLRP3 (0.39) NLRP3ALOX5ALOX5APFEN1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3571187-B1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY GENENTECH INC (US) 2023-11-22 — — EP disclosed
US-11702428-B2 Chemical compounds as inhibitors of interleukin-1 activity GENENTECH, INC. (US) 2023-07-18 — — US disclosed
US-11702428-B2 Chemical compounds as inhibitors of interleukin-1 activity GENENTECH, INC. (US) 2023-07-18 — — US disclosed
US-11702428-B2 Chemical compounds as inhibitors of interleukin-1 activity GENENTECH, INC. (US) 2023-07-18 — — US disclosed
US-20220306649-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY GENENTECH, INC. (US) 2022-09-29 — — US disclosed
US-20210395268-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY GENENTECH, INC. (US) 2021-12-23 — — US disclosed
US-20210395268-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY GENENTECH, INC. (US) 2021-12-23 — — US disclosed
EP-3851434-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY Genentech, Inc. (US) 2021-07-21 — — EP disclosed
US-11040985-B2 Chemical compounds as inhibitors of interleukin-1 activity GENENTECH, INC. (US) 2021-06-22 — — US disclosed
US-11040985-B2 Chemical compounds as inhibitors of interleukin-1 activity GENENTECH, INC. (US) 2021-06-22 — — US disclosed
US-20190337965-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY GENENTECH, INC. (US) 2019-11-07 — — US disclosed
WO-2018136890-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY JECURE THERAPEUTICS, INC. (US) 2018-07-26 — — WO 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 (5 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-20190337965-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY IL1B, IL1A, IL18 NLRP3 8/4885CA12 4567/4885CA1 3177/4885
US-20210395268-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY IL1B, IL1A, IL18 NLRP3 8/4885CA12 4567/4885CA1 3177/4885
US-11040985-B2 Chemical compounds as inhibitors of interleukin-1 activity IL1B, IL1A, IL18 NLRP3 8/4885CA12 4567/4885CA1 3177/4885
US-11702428-B2 Chemical compounds as inhibitors of interleukin-1 activity IL1B, IL1A, IL18 NLRP3 8/4885CA12 4567/4885CA1 3177/4885
US-20220306649-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY IL1B, IL1A, IL18 NLRP3 8/4885CA12 4567/4885CA1 3177/4885

“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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