SCHEMBL24076973

SCHEMBL24076973

CC(C)c1nn(CC(=O)NC2CC(F)(F)C2)c(=O)c2ccc(C(F)(F)F)cc12

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 5/20 0.60
GRIN1 Q05586 2/20 0.46
GRIN2B Q13224 2/20 0.46
GPR139 Q6DWJ6 4/20 0.42
AKR1B1 P15121 5/20 0.41
MAPT P10636 1/20 0.40
CHRNA7 P36544 2/20 0.39
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL24077359 0.93 NLRP3 (0.59) NLRP3GRIN1GRIN2BGPR139AKR1B1
SCHEMBL24077192 0.93 NLRP3 (0.59) NLRP3GRIN1GRIN2BGPR139AKR1B1
SCHEMBL24076954 0.92 NLRP3 (0.58) NLRP3GRIN1GRIN2BGPR139AKR1B1
SCHEMBL24076426 0.92 NLRP3 (0.58) NLRP3GRIN1GRIN2BGPR139AKR1B1
SCHEMBL30168566 0.91 NLRP3 (0.57) NLRP3GRIN1GRIN2BGPR139AKR1B1
SCHEMBL24076366 0.91 NLRP3 (0.57) NLRP3GRIN1GRIN2BGPR139AKR1B1
SCHEMBL25749470 0.90 NLRP3 (0.55) NLRP3GRIN1GRIN2BGPR139AKR1B1
SCHEMBL25748603 0.90 NLRP3 (0.61) NLRP3GRIN1GRIN2BGPR139AKR1B1
SCHEMBL25748626 0.90 NLRP3 (0.61) NLRP3GRIN1GRIN2BGPR139AKR1B1
SCHEMBL24076299 0.89 NLRP3 (0.53) NLRP3GRIN1GRIN2BGPR139AKR1B1

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 1/4885GRIN1 567/4885GRIN2B 1349/4885

“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.