SCHEMBL30662000

SCHEMBL30662000

OP(O)O.c1ccc(-c2ccccc2-c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
HSD17B10 Q99714 2/20 0.57
BCL2L1 Q07817 2/20 0.57
HPGD P15428 1/20 0.57
BACE1 P56817 1/20 0.52
CYP2A6 P11509 1/20 0.50
MAPK1 P28482 1/20 0.50
HDAC4 P56524 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
BCAT2 O15382 1/20 0.46
CHRNB2 P17787 1/20 0.45
CHRNB4 P30926 1/20 0.45
CHRNA3 P32297 1/20 0.45
CHRNA4 P43681 1/20 0.45
PTGS2 P35354 1/20 0.44
ALOX5 P09917 1/20 0.44
DPP4 P27487 1/20 0.44
PDCD1 Q15116 1/20 0.43

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
SCHEMBL12004263 1.00 ALDH1A1 (0.57) ALDH1A1HSD17B10BCL2L1HPGDBACE1
SCHEMBL2361430 0.87 ALDH1A1 (0.61) ALDH1A1HSD17B10BCL2L1HPGDBACE1
SCHEMBL21447 0.87 ALDH1A1 (0.61) ALDH1A1HSD17B10BCL2L1HPGDBACE1
Benzene SCHEMBL28035419 0.87 ALDH1A1 (0.61) ALDH1A1HSD17B10BCL2L1HPGDBACE1
Methyl Alcohol SCHEMBL27490755 0.84 ALDH1A1 (0.60) ALDH1A1HSD17B10BCL2L1HPGDBACE1
SCHEMBL7537444 0.84 ALDH1A1 (0.48) ALDH1A1HSD17B10BCL2L1HPGDBACE1
Biphenyl SCHEMBL1314876 0.83 ALDH1A1 (0.69) ALDH1A1HSD17B10BCL2L1HPGDBACE1
SCHEMBL608537 0.83 ALDH1A1 (0.58) ALDH1A1HSD17B10BCL2L1HPGDBACE1
SCHEMBL13387362 0.83 ALDH1A1 (0.58) ALDH1A1HSD17B10BCL2L1HPGDBACE1
Biphenyl SCHEMBL1994657 0.83 ALDH1A1 (0.69) ALDH1A1HSD17B10BCL2L1HPGDBACE1

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
CN-119948071-A Composition containing ester compound, process for producing the same, polymerizable composition, and process for producing (meth) acrylic polymer 三菱化学株式会社 2025-05-06 CN disclosed
CN-119923418-A Methacrylic acid-containing composition, method for producing methacrylic acid ester, polymerizable composition, and method for producing methacrylic acid polymer 三菱化学株式会社 2025-05-02 CN disclosed
CN-119562975-A Composition containing ester compound and method for producing same, polymerizable composition, (meth) acrylic polymer, and method for producing same 三菱化学株式会社 2025-03-04 CN disclosed
CN-119546653-A Composition containing ester compound and method for producing same, polymerizable composition, (meth) acrylic polymer, and method for producing same 三菱化学株式会社 2025-02-28 CN disclosed
CN-117242103-A Methyl methacrylate-containing composition and method for producing methyl methacrylate polymer 三菱化学株式会社 2023-12-15 CN disclosed
CN-117203245-A Methyl methacrylate-containing composition and method for producing methyl methacrylate polymer 三菱化学株式会社 2023-12-08 CN disclosed
CN-117203249-A Composition containing methyl methacrylate 三菱化学株式会社 2023-12-08 CN disclosed