Allylbenzene

Allylbenzene

SCHEMBL11212669

C=C(C)C(=O)OC.C=CCc1ccccc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
CYP3A4 P08684 3/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TP53 P04637 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
ALOX12 P18054 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTGS1 P23219 1/20 0.42
ELANE P08246 1/20 0.40
KDM4E B2RXH2 2/20 0.39
CNR2 P34972 1/20 0.39
PTGS2 P35354 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPT P10636 1/20 0.38
CYP1A2 P05177 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
Allylbenzene SCHEMBL27781904 0.84 CYP3A4 (0.50) ALDH1A1CYP3A4MEN1KMT2ATDP1
Allylbenzene SCHEMBL8927136 0.84 CYP3A4 (0.43) ALDH1A1CYP3A4MEN1KMT2ATDP1
Allylbenzene SCHEMBL3883984 0.82 ALDH1A1 (0.47) ALDH1A1CYP3A4MEN1KMT2ATDP1
Allylbenzene SCHEMBL28745662 0.82 ALDH1A1 (0.47) ALDH1A1CYP3A4MEN1KMT2ATDP1
Allylbenzene SCHEMBL28194640 0.82 TDP1 (0.41) ALDH1A1CYP3A4MEN1KMT2ATDP1
Ethylbenzene SCHEMBL28055676 0.81 ALDH1A1 (0.54) ALDH1A1TDP1L3MBTL1TP53TSHR
Allylbenzene SCHEMBL28106157 0.81 TDP1 (0.43) ALDH1A1CYP3A4MEN1KMT2ATDP1
Allylbenzene SCHEMBL28084712 0.80 CYP3A4 (0.47) ALDH1A1CYP3A4MEN1KMT2ATDP1
(Chloromethyl)Benzene SCHEMBL28290709 0.80 ALDH1A1 (0.52) ALDH1A1CYP3A4TSHRELANEKDM4E
Allylbenzene SCHEMBL28194878 0.79 HTT (0.44) ALDH1A1CYP3A4MEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110318292-A The manufacturing method of surface paper power reinforcing agent, coating liquid, paper 荒川化学工业株式会社 2019-10-11 CN disclosed
CN-110109324-A Red sensitive resin combination, colour filter and image display device comprising it 东友精细化工有限公司 2019-08-09 CN disclosed
CN-109722125-A Water based shop metallic paint resin 荒川化学工业株式会社 2019-05-07 CN disclosed
CN-109082931-A A kind of paper grade (stock) retention aid and filtering aid reinforcing agent 云梦嘉邦斯新型材料有限公司 2018-12-25 CN disclosed
CN-105735039-B Additive for papermaking and the paper obtained using the additive 荒川化学工业株式会社 2018-11-23 CN disclosed
CN-105463935-B Additive for papermaking and the paper obtained using the additive 荒川化学工业株式会社 2018-07-10 CN disclosed
CN-107604755-A Paper power reinforcing agent, the manufacture method of paper power reinforcing agent, the manufacture method of paper and paper 荒川化学工业株式会社 2018-01-19 CN disclosed
CN-107541986-A Press the manufacture method of paper 荒川化学工业株式会社 2018-01-05 CN disclosed
CN-107280999-A High molecular compound particles and its manufacture method 先进美容科技有限公司 2017-10-24 CN disclosed
EP-0009356-B1 PRODUCTION OF COATING FILMS FROM AUTOXIDISABLE MATERIALS AND COATING COMPOSITIONS CAPABLE OF PRODUCING SUCH FILMS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-10-19 EP disclosed