SCHEMBL11103010

SCHEMBL11103010

C[C@H]1CCCC[C@@H]1N=C=O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
EPHX1 P07099 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL1982615 1.00 ALDH1A1 (0.46) ALDH1A1CA1CA2CA4EPHX1
SCHEMBL23139037 1.00 ALDH1A1 (0.46) ALDH1A1CA1CA2CA4EPHX1
SCHEMBL11103013 1.00 ALDH1A1 (0.46) ALDH1A1CA1CA2CA4EPHX1
SCHEMBL13311938 0.98 ALDH1A1 (0.50) ALDH1A1CA1CA2CA4EPHX1
SCHEMBL9439785 0.94 ALDH1A1 (0.41) ALDH1A1CA1CA2CA4
SCHEMBL24699834 0.85 ALDH1A1 (0.50) ALDH1A1EPHX1
SCHEMBL330951 0.84 ALDH1A1 (0.39) ALDH1A1
SCHEMBL9323923 0.82 ALDH1A1 (0.57) ALDH1A1EPHX1
SCHEMBL5460574 0.82 ALDH1A1 (0.57) ALDH1A1EPHX1
SCHEMBL26012 0.82 ALDH1A1 (0.57) ALDH1A1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250223263-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NodThera Limited (GB) 2025-07-10 US disclosed
US-12247011-B2 Selective inhibitors of NLRP3 inflammasome NodThera Limited (GB) 2025-03-11 US disclosed
CN-111356680-B Selective inhibitors of NLRP3 inflammasome 诺瑟拉有限公司 2023-11-28 CN disclosed
EP-3661921-B1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NODTHERA LTD (GB) 2023-10-18 EP disclosed
US-20210087147-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NodThera Limited (GB) 2021-03-25 US disclosed
CN-111356680-A Selective inhibitors of NLRP3inflammasome 诺瑟拉有限公司 2020-06-30 CN disclosed
US-4442116-A MITICIDES NIPPON SODA COMPANY, LIMITED (JP) 1984-04-10 US disclosed
US-4431814-A HERBICIDES, MITICIDES, ANTICONVULSANTS NIPPON SODA COMPANY LIMITED (JP) 1984-02-14 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 (3 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-12247011-B2 Selective inhibitors of NLRP3 inflammasome NLRP3, NOD1, NLRP1 ALDH1A1 961/4885CA1 3844/4885CA2 3927/4885
US-20250223263-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NLRP3, NOD1, NLRP1 ALDH1A1 961/4885CA1 3844/4885CA2 3927/4885
US-20210087147-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NLRP3, NOD1, NLRP1 ALDH1A1 961/4885CA1 3844/4885CA2 3927/4885

“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.