SCHEMBL25746474

SCHEMBL25746474

CC(C)c1nn(CC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)CC[C@H]2O)c(=O)c2ccc(Br)cc12

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 5/20 0.49
USP30 Q70CQ3 2/20 0.39
KRAS P01116 5/20 0.39
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
TRPV3 Q8NET8 1/20 0.36
FPR2 P25090 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GPR119 Q8TDV5 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
SCHEMBL30168561 1.00 NLRP3 (0.49) NLRP3USP30KRASIDO1TDO2
SCHEMBL26733052 0.90 NLRP3 (0.51) NLRP3USP30KRASFPR2NPSR1
SCHEMBL24077160 0.89 NLRP3 (0.50) NLRP3GPR119
SCHEMBL30231459 0.89 NLRP3 (0.50) NLRP3GPR119
SCHEMBL29426493 0.87 NLRP3 (0.49) NLRP3USP30KRASFPR2
SCHEMBL26732682 0.87 NLRP3 (0.49) NLRP3USP30KRASFPR2
SCHEMBL24077237 0.87 NLRP3 (0.49) NLRP3USP30KRASFPR2
SCHEMBL25751207 0.84 NLRP3 (0.53) NLRP3FPR2NPSR1
SCHEMBL25746485 0.84 NLRP3 (0.55) NLRP3FPR2
SCHEMBL25746482 0.84 NLRP3 (0.53) NLRP3FPR2NPSR1

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
US-20230202989-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 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 (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 1/4885USP30 2071/4885KRAS 3751/4885

“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.