SCHEMBL30835563

SCHEMBL30835563

CC(=O)OC1=C(C)OC(C)(C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ HSP90AB1 P08238 1/20 0.33
▸ ALPG P10696 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ PREP P48147 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ CACNA1B Q00975 1/20 0.31
▸ APBA1 Q02410 1/20 0.31

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
SCHEMBL29049142 0.80 CACNA1B (0.31) ALDH1A1HPGDMAPTHSD17B10PREP
SCHEMBL13144680 0.80 NPC1 (0.32) KDM4EALDH1A1HPGDHSD17B10PREP
SCHEMBL16866077 0.75 PTGS2 (0.34) ALDH1A1
SCHEMBL4202988 0.66 TYR (0.39) LMNA
SCHEMBL14420199 0.65 PTPN1 (0.36) KDM4EALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL13822325 0.65 LMNA (0.32) LMNA
SCHEMBL868447 0.63 LMNA (0.31) LMNA
SCHEMBL11518403 0.63 TYR (0.47) KDM4EALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL7000524 0.61 PREP (0.35) KDM4EALDH1A1GAAHPGDMAPT
SCHEMBL30229482 0.60 ALDH1A1 (0.37) KDM4EALDH1A1GAAHPGDSMN1; 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
CN-117897440-A Method for screening solvent for extraction of polyvinyl chloride, method for recycling waste material, recycled polyvinyl chloride and composition 株式会社LG化学 2024-04-16 — — CN disclosed
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