Benzene

Benzene

SCHEMBL3444341

C=CC=CC(=O)O.c1ccccc1

nearest known ligand 0.44

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.44
TP53 P04637 1/20 0.44
EGLN1 Q9GZT9 1/20 0.44
EGLN3 Q9H6Z9 1/20 0.44
LMNA P02545 2/20 0.42
HCAR2 Q8TDS4 5/20 0.39
HDAC3 O15379 1/20 0.39
TNKS O95271 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
MASP2 O00187 1/20 0.38

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
SCHEMBL51021 0.94
SCHEMBL51020 0.94
SCHEMBL418689 0.94
SCHEMBL28310786 0.91
SCHEMBL27877206 0.91
SCHEMBL23116541 0.91
SCHEMBL15541082 0.91
Hydrochloric Acid SCHEMBL11508580 0.91
Pyridine SCHEMBL29019854 0.86 TSHR (0.39) TSHRTP53EGLN1EGLN3LMNA
Acetic Acid SCHEMBL4280328 0.86 TSHR (0.42) TSHRTP53EGLN1EGLN3LMNA

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-107686457-A A kind of method of the two component reactions synthesis benzene pentadienoic acid ethyl ester compound of 3 thiophenyl 2,4 of ferrous salt catalysis 浙江农林大学暨阳学院 2018-02-13 CN claimed
CN-107686457-B A kind of method of two component reactions synthesis 3- thiophenyl -2,4- benzene pentadienoic acid ethyl ester compound of ferrous salt catalysis 浙江农林大学暨阳学院 2019-08-20 CN disclosed
CN-107686457-A A kind of method of the two component reactions synthesis benzene pentadienoic acid ethyl ester compound of 3 thiophenyl 2,4 of ferrous salt catalysis 浙江农林大学暨阳学院 2018-02-13 CN disclosed
CN-107686457-A A kind of method of the two component reactions synthesis benzene pentadienoic acid ethyl ester compound of 3 thiophenyl 2,4 of ferrous salt catalysis 浙江农林大学暨阳学院 2018-02-13 CN disclosed
EP-2048171-B1 INSULATING LAYER, ELECTRONIC DEVICE AND FIELD EFFECT TRANSISTOR MITSUBISHI CHEM CORP (JP) 2017-11-22 EP disclosed
US-8207524-B2 Insulating layer, electronic device, field effect transistor, and polyvinylthiophenol MITSUBISHI CHEMICAL CORPORATION (JP) 2012-06-26 US disclosed
US-20100001264-A1 INSULATING LAYER, ELECTRONIC DEVICE, FIELD EFFECT TRANSISTOR, AND POLYVINYLTHIOPHENOL MITSUBISHI CHEMICAL CORPORATION (JP) 2010-01-07 US disclosed
EP-2048171-A1 INSULATING LAYER, ELECTRONIC DEVICE, FIELD EFFECT TRANSISTOR, AND POLYVINYLTHIOPHENOL Mitsubishi Chemical Corporation (JP) 2009-04-15 EP disclosed