SCHEMBL7550211

SCHEMBL7550211

C=Cc1cccc(-c2ccccc2)c1C

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 15/20 0.48
CD274 Q9NZQ7 15/20 0.48
ALDH1A1 P00352 1/20 0.39
AKT1 P31749 1/20 0.37
AKT2 P31751 1/20 0.37
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
PSMB5 P28074 1/20 0.36

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
SCHEMBL28139494 0.86 TP53 (0.35) PDCD1CD274ALDH1A1PSMB5
Boric Acid SCHEMBL28856026 0.86 PDCD1 (0.41) PDCD1CD274
SCHEMBL20540071 0.85 ALDH1A1 (0.41) ALDH1A1
SCHEMBL76904 0.81 ALDH1A1 (0.46) ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29418124 0.81 ALDH1A1 (0.46) ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4698367 0.80 PDCD1 (0.48) PDCD1CD274ALDH1A1
SCHEMBL31499183 0.80 PDCD1 (0.48) PDCD1CD274ALDH1A1
SCHEMBL28139493 0.80 ALDH1A1 (0.39) CD274ALDH1A1
O-Xylene SCHEMBL27908796 0.80 TSHR (0.40) PDCD1CD274ALDH1A1AKT1AKT2
Biphenyl SCHEMBL28948287 0.79 ALDH1A1 (0.44) ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6080819-A Blends of olefin polymers and syndiotactic vinyl polymers BOREALIS AG (AT) 2000-06-27 US claimed
CN-115181120-A Preparation method of 2-methyl-3-phenyl styryl pinacol borate 山东百启生物医药有限公司 2022-10-14 CN disclosed
CN-115181120-A Preparation method of 2-methyl-3-phenyl styryl pinacol borate 山东百启生物医药有限公司 2022-10-14 CN disclosed
CN-106957385-A A kind of polyacrylate dispersion, its preparation method, coating and preparation method thereof 贵州黔兴建筑装饰材料有限责任公司 2017-07-18 CN disclosed
EP-1211284-A1 Semi-finished products or moulded materials of improved toughness made from propylene polymers Borealis GmbH (AT) 2002-06-05 EP disclosed
US-6080819-A Blends of olefin polymers and syndiotactic vinyl polymers BOREALIS AG (AT) 2000-06-27 US disclosed
EP-0884356-A2 Blends of polyolefins and syndiotactic vinyl polymeres PCD Polymere AG (AT) 1998-12-16 EP disclosed