SCHEMBL24077041

SCHEMBL24077041

CC(C)c1nn(CC(=O)N[C@H]2C[C@@](C)(O)C2)c(=O)c2ccc(OCC(F)(F)F)cc12

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 8/20 0.47
▸ POLB P06746 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GPR139 Q6DWJ6 2/20 0.35
▸ CHRNA7 P36544 2/20 0.35
▸ SCN9A Q15858 2/20 0.35
▸ GRIN1 Q05586 1/20 0.35
▸ GRIN2B Q13224 1/20 0.35
▸ CACNA1G O43497 1/20 0.34
▸ CACNA1H O95180 1/20 0.34
▸ CACNA1I Q9P0X4 1/20 0.34

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
SCHEMBL24077046 0.90 NLRP3 (0.49) NLRP3GPR139
SCHEMBL25749146 0.88 NLRP3 (0.48) NLRP3POLBALDH1A1GPR139CHRNA7
SCHEMBL24077192 0.87 NLRP3 (0.59) NLRP3GPR139CHRNA7GRIN1GRIN2B
SCHEMBL24077359 0.87 NLRP3 (0.59) NLRP3GPR139CHRNA7GRIN1GRIN2B
SCHEMBL24077057 0.84 NLRP3 (0.51) NLRP3POLBGPR139CHRNA7
SCHEMBL24077073 0.83 NLRP3 (0.52) NLRP3POLBCHRNA7
SCHEMBL24077048 0.83 NLRP3 (0.50) NLRP3POLBCHRNA7
SCHEMBL24077055 0.83 NLRP3 (0.52) NLRP3POLBCHRNA7
SCHEMBL24076326 0.82 NLRP3 (0.58) NLRP3POLBALDH1A1CHRNA7
SCHEMBL24077114 0.82 NLRP3 (0.51) NLRP3POLBGPR139CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 3231/4885ALDH1A1 1603/4885

“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.

Send feedback