SCHEMBL24077073

SCHEMBL24077073

CC(C)c1ccc2c(=O)n(CC(=O)N[C@H]3C[C@@](C)(O)C3)nc(C(C)C)c2c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 10/20 0.52
▸ POLB P06746 1/20 0.38
▸ CHRNA7 P36544 3/20 0.38
▸ HTT P42858 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ RAB9A P51151 1/20 0.35

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
SCHEMBL25749237 0.92 NLRP3 (0.49) NLRP3POLBCHRNA7HTTTHRB
SCHEMBL24077072 0.90 NLRP3 (0.51) NLRP3POLBCHRNA7THRBTP53
SCHEMBL24077291 0.90 NLRP3 (0.47) NLRP3POLBCHRNA7HTTTHRB
SCHEMBL26732419 0.89 NLRP3 (0.58) NLRP3POLBCHRNA7THRB
SCHEMBL26732418 0.89 NLRP3 (0.58) NLRP3POLBCHRNA7THRB
SCHEMBL24077114 0.89 NLRP3 (0.51) NLRP3POLBCHRNA7MEN1KMT2A
SCHEMBL24076326 0.89 NLRP3 (0.58) NLRP3POLBCHRNA7THRB
SCHEMBL24077036 0.89 NLRP3 (0.49) NLRP3POLBCHRNA7HTTTHRB
SCHEMBL24077168 0.89 NLRP3 (0.51) NLRP3POLBCHRNA7HTTTHRB
SCHEMBL24077055 0.88 NLRP3 (0.52) NLRP3POLBCHRNA7HTTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230202989-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 — — US disclosed
US-20230202989-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 — — US disclosed
WO-2021239885-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-12-02 — — 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-20230202989-A1 COMPOUNDS NLRP3, NLRP1, IL1B NLRP3 1/4885POLB 3231/4885CHRNA7 4582/4885

“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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