SCHEMBL7927491

SCHEMBL7927491

C=CCOc1ccc(CCO)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
POLB P06746 2/20 0.46
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
USP2 O75604 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HRH3 Q9Y5N1 1/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
RAB9A P51151 1/20 0.44
BCHE P06276 1/20 0.44
LMNA P02545 1/20 0.44

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
Acrylic Acid SCHEMBL28972693 0.90 FFAR1 (0.46) CA2CA12CA1CA7CA9
SCHEMBL8420396 0.89 LTA4H (0.56) CA2CA12CA1CA7CA9
SCHEMBL23642842 0.87 LTA4H (0.50) CA2CA12CA1CA7CA9
SCHEMBL2521425 0.84 CA12 (0.50) CA2CA12CA1CA7CA9
SCHEMBL2150158 0.84 CA12 (0.50) CA2CA12CA1CA7CA9
SCHEMBL3418564 0.83 ESR1 (0.52) CA2CA12CA1CA7CA9
SCHEMBL17226148 0.82 CA12 (0.49) CA2CA12CA1CA7CA9
1,4-Diallyloxybenzene SCHEMBL302448 0.81 CA12 (0.63) CA2CA12CA1CA7CA9
SCHEMBL1244893 0.81 PPARA (0.45) CA2CA12CA1CA7CA9
SCHEMBL3627757 0.81 THRB (0.54) CA2CA12CA1CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111153773-A Preparation method of benzyl vinyl ether and monomer copolymer thereof 重庆市化工研究院 2020-05-15 CN claimed
CN-114716604-B Production process of electronic resin material 重庆市化工研究院有限公司 2023-03-21 CN disclosed
CN-114716604-A Production process of electronic resin material 重庆市化工研究院有限公司 2022-07-08 CN disclosed
CN-111153773-A Preparation method of benzyl vinyl ether and monomer copolymer thereof 重庆市化工研究院 2020-05-15 CN disclosed
US-6231714-B1 BONDING PAIR OF SUBSTRATES LOCTITE CORPORATION 2001-05-15 US disclosed
WO-2000032550-A1 ALLYLIC PHENYL ETHER (METH)ACRYLATE COMPOSITIONS AND NOVEL ALLYLIC PHENYL ETHER (METH)ACRYLATE MONOMERS LOCTITE CORPORATION (US) 2000-06-08 WO disclosed
US-4652563-A PYRIDAZINONES SUBSTITUTED WITH CYCLOPROPYLMETHOXYETHYL GROUP SMITH KLINE & FRENCH LABORATORIES LTD. (GB) 1987-03-24 US disclosed
EP-0168921-A2 Chemical compounds SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1986-01-22 EP disclosed