SCHEMBL25356382

SCHEMBL25356382

CC(C)n1nc(CC(=O)Nc2ccc3nncn3n2)c(=O)c2ccc(C3CC3)cc21

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 8/20 0.49
▸ KDM4E B2RXH2 4/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ GAA P10253 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ CCL2 P13500 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ EED O75530 1/20 0.32
▸ RBBP4 Q09028 1/20 0.32
▸ SUZ12 Q15022 1/20 0.32
▸ EZH2 Q15910 1/20 0.32
▸ RBBP7 Q16576 1/20 0.32
▸ MALT1 Q9UDY8 1/20 0.31

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
SCHEMBL29492104 0.80 NLRP3 (0.75) NLRP3EEDRBBP4SUZ12EZH2
SCHEMBL24076988 0.76 NLRP3 (0.59) NLRP3SMN1; SMN2BRD4
SCHEMBL24077285 0.73 NLRP3 (0.58) NLRP3KDM4EALDH1A1
SCHEMBL26909947 0.69 NLRP3 (0.47) NLRP3
SCHEMBL25357321 0.68 NLRP3 (0.53) NLRP3POLB
SCHEMBL29492112 0.68 NLRP3 (0.53) NLRP3POLB
SCHEMBL25355877 0.68 NLRP3 (0.38) NLRP3POLBEEDRBBP4SUZ12
SCHEMBL25428366 0.68 NLRP3 (0.58) NLRP3KDM4EALDH1A1
SCHEMBL23950977 0.67 NLRP3 (0.55) NLRP3
SCHEMBL29492036 0.66 NLRP3 (1.00) NLRP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4217346-B1 NEW COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2025-07-02 — — EP disclosed
US-20230391756-A1 NEW COMPOUND JANSSEN PHARMACEUTICA NV (BE) 2023-12-07 — — US disclosed
EP-4217346-A1 NEW COMPOUNDS JANSSEN Pharmaceutica NV (BE) 2023-08-02 — — EP disclosed
WO-2022063876-A1 NEW COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2022-03-31 — — 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 (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-20230391756-A1 NEW COMPOUND NLRP3, NLRP1, IL1R1 NLRP3 1/4885KDM4E 4394/4885ALDH1A1 3008/4885

“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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