SCHEMBL31045604

SCHEMBL31045604

COC(=O)C1(c2ccc(C3CC3)cc2OC)CC1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 15/20 0.44
▸ PDE4A P27815 6/20 0.44
▸ PDE4C Q08493 6/20 0.44
▸ PDE4D Q08499 6/20 0.44
▸ QDPR P09417 2/20 0.44
▸ TYK2 P29597 1/20 0.38
▸ NR3C1 P04150 1/20 0.37
▸ HIF1A Q16665 1/20 0.36

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
SCHEMBL20790105 0.89 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DQDPR
SCHEMBL31045596 0.87 PDE4B (0.48) PDE4BPDE4APDE4CPDE4DQDPR
SCHEMBL31045649 0.80 LPAR1 (0.48) —
SCHEMBL31045810 0.78 MEN1 (0.43) —
SCHEMBL31045886 0.78 ALDH1A1 (0.42) —
SCHEMBL20789882 0.77 PDE4B (0.36) PDE4BPDE4APDE4CPDE4DQDPR
SCHEMBL20790143 0.76 PDE4B (0.48) PDE4BPDE4APDE4CPDE4DQDPR
SCHEMBL20789988 0.76 PDE4B (0.37) PDE4BPDE4APDE4CPDE4DQDPR
SCHEMBL31045701 0.76 ALDH1A1 (0.44) —
SCHEMBL31045563 0.75 RXRA (0.40) PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4680336-A1 AMIDE DERIVATIVES FOR INHIBITING NLRP3 AND USES THEREOF Ventus Therapeutics U.S., Inc. (US) 2026-01-21 — — EP disclosed
US-20260007684-A1 AMIDE DERIVATIVES FOR INHIBITING NLRP3 AND USES THEREOF VENTUS THERAPEUTICS U S INC (US) 2026-01-08 — — US disclosed
WO-2024196788-A1 AMIDE DERIVATIVES FOR INHIBITING NLRP3 AND USES THEREOF VENTUS THERAPEUTICS U.S., INC. (US) 2024-09-26 — — 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-20260007684-A1 AMIDE DERIVATIVES FOR INHIBITING NLRP3 AND USES THEREOF NOD1, NLRP3, NOD2 PDE4B 1817/4885PDE4A 1795/4885PDE4C 2977/4885

“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.

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