SCHEMBL4779153

SCHEMBL4779153

OC(O)(CCc1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.50
CYP2C19 P33261 3/20 0.50
CYP1A2 P05177 2/20 0.50
TDP1 Q9NUW8 2/20 0.46
KIF11 P52732 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
CASP1 P29466 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CHRM3 P20309 2/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
KEAP1 Q14145 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2A6 P11509 1/20 0.41
HTR2A P28223 1/20 0.41

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
SCHEMBL10537491 0.87 CYP1A2 (0.47) CYP2C9CYP2C19CYP1A2TDP1ALOX15
SCHEMBL8710101 0.85 MAOA (0.47) CYP2C9CYP2C19CYP1A2ALOX15CHRM3
SCHEMBL27696460 0.84 MAPT (0.48) CYP2C9CYP2C19CYP1A2CHRM3CES1
SCHEMBL28065368 0.82 SMN1; SMN2 (0.52) CYP2C9CYP2C19CYP1A2TDP1KIF11
SCHEMBL8375787 0.78 CYP1A2 (0.47) CYP2C9CYP2C19CYP1A2TDP1KIF11
SCHEMBL11787463 0.78 CYP2C9 (0.47) CYP2C9CYP2C19CYP1A2TDP1KIF11
SCHEMBL26326648 0.78 CYP2C19 (0.47) CYP2C9CYP2C19CYP1A2TDP1KIF11
SCHEMBL27491063 0.78 CYP1A2 (0.47) CYP2C9CYP2C19CYP1A2TDP1KIF11
SCHEMBL7196259 0.78 TDP1 (0.52) CYP2C9CYP2C19CYP1A2TDP1ALDH1A1
SCHEMBL11212708 0.76 CYP2C19 (0.43) CYP2C9CYP2C19CYP1A2TDP1KIF11

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119978546-A Solid organic tin composite heat stabilizer technological formula 宁夏睿欣科技发展有限公司 2025-05-13 CN claimed
CN-112745833-B Preparation method of time-resolved fluorescence magnetic nanoparticle 华侨大学 2024-01-05 CN claimed
CN-114011465-B Granular porous perfluorinated sulfonic acid resin catalyst and preparation method and application thereof 上海应用技术大学 2023-08-29 CN claimed
CN-119978546-A Solid organic tin composite heat stabilizer technological formula 宁夏睿欣科技发展有限公司 2025-05-13 CN disclosed
CN-119978546-A Solid organic tin composite heat stabilizer technological formula 宁夏睿欣科技发展有限公司 2025-05-13 CN disclosed
CN-112745833-B Preparation method of time-resolved fluorescence magnetic nanoparticle 华侨大学 2024-01-05 CN disclosed
CN-114011465-B Granular porous perfluorinated sulfonic acid resin catalyst and preparation method and application thereof 上海应用技术大学 2023-08-29 CN disclosed
EP-1915053-A2 NOVEL 2'-C-METHYL AND 4'-C-METHYL NUCLEOSIDE DERIVATIVES Merck & Co., Inc. (US) 2008-04-30 EP disclosed
WO-2007022073-A2 NOVEL 2'-C-METHYL AND 4'-C-METHYL NUCLEOSIDE DERIVATIVES MERCK & CO., INC. (US) 2007-02-22 WO disclosed