SCHEMBL25746480

SCHEMBL25746480

CCN1CC[C@H](NC(=O)Cn2nc(C(C)C)c3cc(C)ccc3c2=O)[C@H](O)C1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 5/20 0.42
HTT P42858 3/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
TSHR P16473 3/20 0.36
MCHR1 Q99705 1/20 0.36
GPR139 Q6DWJ6 2/20 0.35
NPSR1 Q6W5P4 3/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.34
PKM P14618 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
SCHEMBL25746479 1.00 NLRP3 (0.42) NLRP3HTTALDH1A1POLBRXFP1
SCHEMBL25746478 1.00 NLRP3 (0.42) NLRP3HTTALDH1A1POLBRXFP1
SCHEMBL24076422 0.88 NLRP3 (0.53) NLRP3MCHR1GPR139KMT2AMAPT
SCHEMBL24076947 0.88 NLRP3 (0.53) NLRP3MCHR1GPR139KMT2AMAPT
SCHEMBL24076946 0.88 NLRP3 (0.53) NLRP3MCHR1GPR139KMT2AMAPT
SCHEMBL24076298 0.88 NLRP3 (0.53) NLRP3MCHR1GPR139KMT2AMAPT
SCHEMBL26732428 0.85 KMT2A (0.46) NLRP3POLBNPSR1KMT2AMAPT
SCHEMBL25746337 0.85 KMT2A (0.46) NLRP3POLBNPSR1KMT2AMAPT
SCHEMBL26732427 0.85 KMT2A (0.46) NLRP3POLBNPSR1KMT2AMAPT
SCHEMBL25746482 0.84 NLRP3 (0.53) NLRP3ALDH1A1RXFP1MCHR1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1/4885HTT 3267/4885ALDH1A1 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.