Anisole

Anisole

SCHEMBL7290982

C=CC(=O)O.COc1ccccc1

nearest known ligand 0.61

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.61
CES2 O00748 2/20 0.53
CES1 P23141 2/20 0.53
LTA4H P09960 1/20 0.52
TGM2 P21980 2/20 0.52
TSHR P16473 1/20 0.51
THRB P10828 2/20 0.50
ATM Q13315 1/20 0.50
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
GAA P10253 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
HSPD1 P10809 1/20 0.47
TNFRSF1A P19438 1/20 0.47
MAOB P27338 1/20 0.47
HSPE1 P61604 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP1B1 Q16678 1/20 0.47

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
Anisole SCHEMBL28780062 0.98 CA4 (0.58) CA4CES2CES1LTA4HTGM2
Anisole SCHEMBL28850433 0.92 CA4 (0.52) CA4CES2CES1LTA4HTGM2
Anisole SCHEMBL28210636 0.86 ESR2 (0.56) CA4ALDH1A1MAPTMEN1KMT2A
Anisole SCHEMBL5337693 0.86 CA4 (0.54) CA4CES2CES1LTA4HTGM2
Anisole SCHEMBL28090693 0.86 CA4 (0.54) CA4CES2CES1LTA4HTGM2
Acrylic Acid SCHEMBL1311380 0.85 TGM2 (0.55) CES2CES1TGM2TSHRTHRB
Acrylic Acid SCHEMBL27653442 0.84 AKT1 (0.50) LTA4HTGM2TSHRTHRBATM
Anisole SCHEMBL5864971 0.84 CA4 (0.78) CA4CES2CES1LTA4HCA1
Anisole SCHEMBL4965675 0.84 CA4 (0.78) CA4CES2CES1LTA4HCA1
Mequinol SCHEMBL1260964 0.83 ESR2 (0.57) CES2CES1LTA4HTGM2THRB

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105884731-B Chlorine Bezalip Tablets methoxybenzene acrylate compounds and its synthetic method 江西中医药大学 2018-04-10 CN claimed
CN-105778179-B A kind of rubber composition and application 南京思凯橡塑制品有限公司 2018-02-02 CN claimed
CN-105884731-A Chlorophenoxy isobutyric acid methoxy phenyl acrylate compound and synthesis method thereof 江西中医药大学 2016-08-24 CN claimed
CN-105778179-A Rubber composition and application thereof 南京思凯橡塑制品有限公司 2016-07-20 CN claimed
CN-101195570-B Salt amino acid of ferulic acid NANJING XINGANG PHARMACEUTICAL CO LTD 2011-02-02 CN claimed
CN-101721400-A Action of ferulic acid on enhancing drug effect of some medicaments and purpose thereof QINGDAO QIYUAN BIOTECH CO LTD 2010-06-09 CN claimed
CN-101195570-A Salt amino acid of ferulic acid ZHENHUA HUANG (CN) 2008-06-11 CN claimed
CN-104926891-B Bioactive ingredients and medicinal usage in Green Bamboo Leaf Liquor 石河子大学 2018-06-05 CN disclosed
CN-105884731-B Chlorine Bezalip Tablets methoxybenzene acrylate compounds and its synthetic method 江西中医药大学 2018-04-10 CN disclosed
CN-105884731-B Chlorine Bezalip Tablets methoxybenzene acrylate compounds and its synthetic method 江西中医药大学 2018-04-10 CN disclosed
CN-105884731-B Chlorine Bezalip Tablets methoxybenzene acrylate compounds and its synthetic method 江西中医药大学 2018-04-10 CN disclosed
CN-105778179-B A kind of rubber composition and application 南京思凯橡塑制品有限公司 2018-02-02 CN disclosed
CN-104961782-B Bioactive ingredients and its medical usage in Green Bamboo Leaf Liquor 石河子大学 2017-12-19 CN disclosed
CN-105778179-A Rubber composition and application thereof 南京思凯橡塑制品有限公司 2016-07-20 CN disclosed
CN-102190658-A Structural analogue of antineoplastic marine natural product ecteinascidins INST MATERIA MEDICA CAMS 2011-09-21 CN disclosed
CN-100424068-C Anti-oxidizing derivative of aspirin and its synthetic method and use CHINA OCEANOGRAPHIC UNIV (CN) 2008-10-08 CN disclosed
CN-1616404-A Anti-oxidizing derivative of aspirin and its synthetic method and use CHINA OCEANOGRAPHIC UNIV (CN) 2005-05-18 CN disclosed
EP-0394101-B1 Benzothiazepine derivatives, process for their preparation and thereby obtained intermediates, their use as medicines and compositions containing them ROUSSEL UCLAF (FR) 1994-08-24 EP disclosed
US-5063225-A Antiarrhythmia ROUSSEL UCLAF (FR) 1991-11-05 US disclosed
EP-0394101-A1 Benzothiazepine derivatives, process for their preparation and thereby obtained intermediates, their use as medicines and compositions containing them ROUSSEL-UCLAF (FR) 1990-10-24 EP disclosed