SCHEMBL31387285

SCHEMBL31387285

CC1(C)OB(C2=CC3(CC2)COC3)OC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.46
▸ P2RX7 Q99572 1/20 0.44
▸ LPL P06858 1/20 0.30
▸ LIPG Q9Y5X9 1/20 0.30

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
SCHEMBL25136361 0.79 MAPK1 (0.46) MAPK1P2RX7LPLLIPG
SCHEMBL24514841 0.77 P2RX7 (0.50) MAPK1P2RX7LPLLIPG
SCHEMBL31570452 0.76 P2RX7 (0.55) MAPK1P2RX7LPLLIPG
SCHEMBL23124003 0.72 MAPK1 (0.51) MAPK1P2RX7
SCHEMBL29082175 0.70 P2RX7 (0.56) MAPK1P2RX7LPLLIPG
SCHEMBL18095998 0.68 P2RX7 (0.48) MAPK1P2RX7LPLLIPG
SCHEMBL14330689 0.68 P2RX7 (0.57) MAPK1P2RX7LPLLIPG
SCHEMBL21315396 0.67 MAPK1 (0.45) MAPK1P2RX7
SCHEMBL19435668 0.67 P2RX7 (0.40) MAPK1P2RX7
SCHEMBL1701389 0.67 P2RX7 (0.56) MAPK1P2RX7LPLLIPG

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
WO-2024255765-A1 NOVEL COMPOUNDS, COMPOSITIONS COMPRISING THE SAME AND USES THEREOF NUPHASE THERAPEUTICS (HANGZHOU) LIMITED., CO. (CN) 2024-12-19 — — WO disclosed
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