SCHEMBL30965873

SCHEMBL30965873

CC1(O)CC=C(B2OC(C)(C)C(C)(C)O2)C1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 1/20 0.47
▸ MAPK1 P28482 1/20 0.44
▸ LPL P06858 3/20 0.32
▸ LIPG Q9Y5X9 3/20 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
SCHEMBL17256462 0.80 P2RX7 (0.50) P2RX7MAPK1LPLLIPG
SCHEMBL31387215 0.74 MAPK1 (0.46) P2RX7MAPK1LPLLIPG
SCHEMBL20010552 0.74 P2RX7 (0.53) P2RX7MAPK1LPLLIPG
SCHEMBL14540096 0.70 MAPK1 (0.42) P2RX7MAPK1
SCHEMBL25411921 0.70 P2RX7 (0.37) P2RX7MAPK1
SCHEMBL1701389 0.69 P2RX7 (0.56) P2RX7MAPK1LPLLIPG
SCHEMBL31472207 0.69 P2RX7 (0.47) P2RX7MAPK1LPLLIPG
SCHEMBL253582 0.69 P2RX7 (0.56) P2RX7MAPK1LPLLIPG
SCHEMBL2019231 0.69 MAPK1 (0.53) P2RX7MAPK1LPLLIPG
SCHEMBL24366945 0.69 P2RX7 (0.56) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024120378-A2 TRIAZOLE COMPOUNDS, PREPARATION METHODS AND MEDICINAL USES THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-06-13 — — WO disclosed
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