Allylbenzene

Allylbenzene

SCHEMBL793624

C=CCc1ccccc1.c1ccc(C2CCCCC2)cc1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.45
SIGMAR1 Q99720 4/20 0.41
CYP2D6 P10635 4/20 0.40
CYP2C19 P33261 3/20 0.40
CYP3A4 P08684 2/20 0.40
CYP1A2 P05177 2/20 0.40
TSHR P16473 2/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP11B2 P19099 1/20 0.40
KMO O15229 1/20 0.39
CYP2C9 P11712 2/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL251315 0.87 ALDH1A1 (0.41) CYP3A4CYP1A2TSHRMEN1TP53
SCHEMBL30731352 0.79 SLC18A3 (0.63) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
SCHEMBL19262690 0.79 SLC18A3 (0.63) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
Benzene SCHEMBL11808437 0.79 SLC18A3 (0.63) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
SCHEMBL19198566 0.79 SLC18A3 (0.63) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
SCHEMBL790829 0.79 SLC18A3 (0.63) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
SCHEMBL42833 0.79 SLC18A3 (0.63) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
SCHEMBL11562787 0.79 SLC18A3 (0.63) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
SCHEMBL447032 0.79 SLC18A3 (0.63) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
SCHEMBL190370 0.79 SLC18A3 (0.63) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10584096-B2 Cyclic imide slurry compositions EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-03-10 US disclosed
US-20190233373-A1 Cyclic Imide Slurry Compositions EXXONMOBIL CHEMICAL PATENTS INC. 2019-08-01 US disclosed
EP-2935183-B1 PROCESS FOR MAKING PHENOL AND/OR CYCLOHEXANONE EXXONMOBIL CHEMICAL PATENTS INC (US) 2019-01-30 EP disclosed
CN-105646156-B The method for being used to prepare phenol 埃克森美孚化学专利公司 2018-07-13 CN disclosed
WO-2018075176-A1 CYCLIC IMIDE SLURRY COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-04-26 WO disclosed
US-9815759-B2 Processes for producing phenol EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-11-14 US disclosed
CN-103848712-B cyclohexane dehydrogenation 埃克森美孚化学专利公司 2017-01-11 CN disclosed
EP-2895454-B1 PROCESS FOR SEPARATING METHYLCYCLOPENTANONE FROM CYCLOHEXANONE EXXONMOBIL CHEM PATENTS INC (US) 2016-11-30 EP disclosed
US-9469588-B2 Alkylating process EXXONMOBIL CHEMICAL PATENTS INC. (US) 2016-10-18 US disclosed
CN-103880601-B The method preparing phenol and/or cyclohexanone 埃克森美孚化学专利公司 2016-08-31 CN disclosed
CN-103052610-A Cyclohexylbenzene compositions EXXONMOBIL CHEM PATENTS INC 2013-04-17 CN disclosed
WO-2012036820-A1 CYCLOHEXYLBENZENE HYDROPEROXIDE COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036828-A1 PROCESSES FOR PRODUCING PHENOL EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036826-A2 PROCESSES FOR PRODUCING PHENOL EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036830-A1 CYCLOHEXYLBENZENE COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036818-A1 CYCLOHEXANONE COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036827-A1 PROCESSES FOR PRODUCING PHENOL EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036822-A1 PHENOL AND CYCLOHEXANONE MIXTURES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036821-A1 PHENOL COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036823-A1 PHENOL AND CYCLOHEXANONE MIXTURES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190233373-A1 Cyclic Imide Slurry Compositions ADH1C, ADH1A, ADH5 SLC18A3 4469/4885SIGMAR1 1091/4885CYP2D6 868/4885
US-10584096-B2 Cyclic imide slurry compositions ADH1C, ADH1A, ADH5 SLC18A3 4469/4885SIGMAR1 1091/4885CYP2D6 868/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.