Benzene

Benzene

SCHEMBL28834320

COc1cccc(OC)c1C(=O)[P](=O)C(=O)c1c(OC)cccc1OC.c1ccccc1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.64
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
CA7 P43166 1/20 0.64
CA9 Q16790 1/20 0.64
CA14 Q9ULX7 1/20 0.64
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 2/20 0.45
TAAR1 Q96RJ0 1/20 0.45
PPARA Q07869 1/20 0.44
POLB P06746 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42

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
SCHEMBL3306485 0.98 CA12 (0.61) CA12CA1CA2CA7CA9
Hexane SCHEMBL8530050 0.88 PPARA (0.56) CA12CA1CA2CA7CA9
SCHEMBL28735754 0.87 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL23610603 0.82 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL27874203 0.79 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL7865371 0.79 CA12 (0.58) CA12CA1CA2CA7CA9
SCHEMBL274749 0.79 CA12 (0.58) CA12CA1CA2CA7CA9
SCHEMBL4236775 0.79 CA12 (0.69) CA12CA1CA2CA7CA9
2,6-Dimethoxybenzoic Acid SCHEMBL149926 0.79 CA12 (1.00) CA12CA1CA2CA7CA9
SCHEMBL11127999 0.78 CA12 (0.57) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116457203-A Surface protective film 日东电工株式会社 2023-07-18 CN disclosed
CN-114981376-A Double-sided adhesive tape 日东电工株式会社 2022-08-30 CN disclosed
CN-113825787-A Method for manufacturing heat storage sheet 昭和电工材料株式会社 2021-12-21 CN disclosed
CN-113557252-A Curable composition, heat-accumulative material and article 昭和电工材料株式会社 2021-10-26 CN disclosed
CN-110484170-B Adhesive composition, adhesive layer, and adhesive sheet 日东电工株式会社 2021-08-10 CN disclosed