SCHEMBL24077175

SCHEMBL24077175

C[C@]1(O)C[C@@H](NC(=O)Cn2nc(C3CC3)c3cc(C(F)(F)F)ccc3c2=O)C1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 5/20 0.48
NLRP3 Q96P20 6/20 0.44
CCR2 P41597 2/20 0.41
AKR1B1 P15121 4/20 0.40
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
KCNH2 Q12809 1/20 0.38
CCRL2 O00421 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
SCHEMBL25746328 0.87 CHRNA7 (0.51) CHRNA7NLRP3MAPT
SCHEMBL24076407 0.86 NLRP3 (0.46) CHRNA7NLRP3AKR1B1MAPTTDP1
SCHEMBL24077174 0.86 NLRP3 (0.45) NLRP3AKR1B1MAPT
SCHEMBL24077362 0.86 NLRP3 (0.46) CHRNA7NLRP3AKR1B1MAPTCCRL2
SCHEMBL24077040 0.86 CHRNA7 (0.50) CHRNA7NLRP3
SCHEMBL24077340 0.86 CHRNA7 (0.50) CHRNA7NLRP3
SCHEMBL24077359 0.85 NLRP3 (0.59) CHRNA7NLRP3CCR2AKR1B1MAPT
SCHEMBL24077192 0.85 NLRP3 (0.59) CHRNA7NLRP3CCR2AKR1B1MAPT
SCHEMBL24076428 0.85 NLRP3 (0.50) CHRNA7NLRP3AKR1B1MAPTCCRL2
SCHEMBL29348105 0.85 NLRP3 (0.50) CHRNA7NLRP3CCR2AKR1B1MAPT

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 CHRNA7 4582/4885NLRP3 1/4885CCR2 394/4885

“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.