SCHEMBL30965884

SCHEMBL30965884

CC(C)(C)OC(=O)N1CCC(B2OC(C)(C)C(C)(C)O2)=C(F)C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.41
▸ NR1H2 P55055 3/20 0.40
▸ USP30 Q70CQ3 1/20 0.40
▸ USP2 O75604 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ADORA1 P30542 2/20 0.38
▸ MAPT P10636 3/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HPGDS O60760 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ BACE2 Q9Y5Z0 1/20 0.33

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
SCHEMBL25305107 0.86 ESR2 (0.44) ESR2NR1H2USP30USP2SMN1; SMN2
SCHEMBL8252594 0.84 ADORA1 (0.42) ESR2NR1H2USP30USP2SMN1; SMN2
SCHEMBL11981955 0.83 NR1H2 (0.41) ESR2NR1H2USP30USP2SMN1; SMN2
SCHEMBL26134367 0.80 USP30 (0.39) USP30USP2SMN1; SMN2
SCHEMBL1081654 0.79 ADORA1 (0.47) ESR2NR1H2USP30USP2SMN1; SMN2
SCHEMBL2483591 0.77 ADORA1 (0.47) ESR2NR1H2USP30USP2SMN1; SMN2
SCHEMBL2809259 0.76 ESR2 (0.51) ESR2NR1H2USP30MAPTMAPK1
SCHEMBL38653270 0.76 ESR2 (0.41) ESR2NR1H2USP30ADORA1MAPT
SCHEMBL25934807 0.76 ESR2 (0.46) ESR2NR1H2USP30ADORA1MAPT
SCHEMBL29023102 0.75 USP30 (0.37) ESR2NR1H2USP30USP2SMN1; SMN2

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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