SCHEMBL30938593

SCHEMBL30938593

CC1(C)OB(c2ccc3c(c2O)CC3)OC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.35
MAPK1 P28482 1/20 0.33
LPL P06858 4/20 0.32
LIPG Q9Y5X9 4/20 0.32

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
SCHEMBL24840121 0.90 P2RX7 (0.37) P2RX7MAPK1LPLLIPG
SCHEMBL30414499 0.76 MAPK1 (0.34) P2RX7MAPK1
SCHEMBL25419802 0.76 MAPK1 (0.34) P2RX7MAPK1
SCHEMBL30768992 0.76 LPL (0.37) P2RX7MAPK1LPLLIPG
SCHEMBL24374129 0.74 P2RX7 (0.34) P2RX7
SCHEMBL18328347 0.72 LPL (0.38) P2RX7MAPK1LPLLIPG
SCHEMBL30973518 0.72
SCHEMBL21732624 0.71 P2RX7 (0.37) P2RX7MAPK1LPLLIPG
SCHEMBL10158544 0.71 P2RX7 (0.37) P2RX7MAPK1LPLLIPG
SCHEMBL30042926 0.71 P2RX7 (0.37) P2RX7MAPK1LPLLIPG

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-4615841-A1 TRIAZINONE DERIVATIVES AS NLRP3 INHIBITORS F. Hoffmann-La Roche AG (CH) 2025-09-17 EP disclosed
WO-2025045961-A1 INHIBITORS OF THE NLRP3 INFLAMMASOME F. HOFFMANN-LA ROCHE AG (CH) 2025-03-06 WO disclosed
WO-2024099992-A1 TRIAZINONE DERIVATIVES AS NLRP3 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2024-05-16 WO disclosed