SCHEMBL29565700

SCHEMBL29565700

C[C@H]1[C@@H](Nc2ccc(Cl)nn2)CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.44
PREP P48147 3/20 0.44
TSHR P16473 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
ACE2 Q9BYF1 1/20 0.43
HCRTR1 O43613 3/20 0.43
HCRTR2 O43614 3/20 0.43
PRCP P42785 1/20 0.43
GFER P55789 1/20 0.43
CTRB1 P17538 1/20 0.43

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
SCHEMBL22654904 0.82 HCRTR1 (0.46) HCRTR1HCRTR2
SCHEMBL22654902 0.82 HCRTR1 (0.46) HCRTR1HCRTR2
SCHEMBL22654906 0.82 HCRTR1 (0.46) HCRTR1HCRTR2
SCHEMBL3070688 0.80 PREP (0.53) NPSR1PREPTSHRL3MBTL1KDM4E
SCHEMBL3070684 0.80 PREP (0.53) NPSR1PREPTSHRL3MBTL1KDM4E
SCHEMBL3070690 0.80 PREP (0.53) NPSR1PREPTSHRL3MBTL1KDM4E
SCHEMBL13434443 0.78 ACE2 (0.55) NPSR1PREPTSHRL3MBTL1KDM4E
SCHEMBL13434440 0.78 ACE2 (0.55) NPSR1PREPTSHRL3MBTL1KDM4E
SCHEMBL13631108 0.78 ACE2 (0.55) NPSR1PREPTSHRL3MBTL1KDM4E
SCHEMBL16789713 0.77 PREP (0.49) NPSR1PREPTSHRL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250270188-A1 NLRP3 INFLAMMASOME INHIBITORS NOVARTIS AG (CH) 2025-08-28 US disclosed
US-12139471-B2 NLRP3 inflammasome inhibitors NOVARTIS AG (CH) 2024-11-12 US disclosed
US-20220251067-A1 NLRP3 INFLAMMASOME INHIBITORS NOVARTIS AG (CH) 2022-08-11 US disclosed
US-11254653-B2 NLRP3 inflammasome inhibitors NOVARTIS AG (CH) 2022-02-22 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 (4 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-11254653-B2 NLRP3 inflammasome inhibitors NLRP3, NLRP1, NOD1 NPSR1 1056/4885PREP 1221/4885TSHR 2465/4885
US-20220251067-A1 NLRP3 INFLAMMASOME INHIBITORS NLRP3, NLRP1, NOD1 NPSR1 1056/4885PREP 1221/4885TSHR 2465/4885
US-12139471-B2 NLRP3 inflammasome inhibitors NLRP3, NLRP1, NOD1 NPSR1 1056/4885PREP 1221/4885TSHR 2465/4885
US-20250270188-A1 NLRP3 INFLAMMASOME INHIBITORS NLRP3, NLRP1, NOD1 NPSR1 1056/4885PREP 1221/4885TSHR 2465/4885

“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.