SCHEMBL24077261

SCHEMBL24077261

CCc1nn(CC(=O)Nc2ccc3nncn3c2)c(=O)c2ccc(Br)cc12

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 14/20 0.52
FPR1 P21462 3/20 0.43
FPR2 P25090 3/20 0.43
AKR1B1 P15121 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL25746334 0.90 NLRP3 (0.53) NLRP3AKR1B1LMNATP53ALOX15
SCHEMBL24077172 0.88 AKR1B1 (0.53) NLRP3AKR1B1
SCHEMBL24077003 0.87 NLRP3 (0.52) NLRP3FPR1FPR2LMNATP53
SCHEMBL24076325 0.86 NLRP3 (0.64) NLRP3FPR1FPR2
SCHEMBL29348115 0.86 NLRP3 (0.51) NLRP3FPR1FPR2LMNATP53
SCHEMBL24077255 0.86 NLRP3 (0.55) NLRP3AKR1B1LMNATP53ALOX15
SCHEMBL24076404 0.86 NLRP3 (0.58) NLRP3FPR1FPR2LMNATP53
SCHEMBL24077337 0.85 NLRP3 (0.53) NLRP3FPR1FPR2LMNATP53
SCHEMBL24077162 0.85 NLRP3 (0.55) NLRP3FPR1FPR2AKR1B1LMNA
SCHEMBL24076395 0.84 NLRP3 (0.56) NLRP3FPR1FPR2

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 1/4885FPR1 17/4885FPR2 58/4885

“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.