Allylbenzene

Allylbenzene

SCHEMBL18550554

C=CCc1ccccc1.CNC

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.50
CYP3A4 P08684 2/20 0.48
TP53 P04637 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 2/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
ALOX12 P18054 1/20 0.48
CNR2 P34972 1/20 0.45
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
CALM1 P0DP23 1/20 0.43
TAAR1 Q96RJ0 3/20 0.43
ATM Q13315 1/20 0.43
SLC18A2 Q05940 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.40
PPARG P37231 1/20 0.39
PPARD Q03181 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
Allylbenzene SCHEMBL254037 0.98 CYP3A4 (0.48) MAOBCYP3A4TP53SMN1; SMN2ALDH1A1
Allylbenzene SCHEMBL28162046 0.96 CYP3A4 (0.46) MAOBCYP3A4TP53SMN1; SMN2ALDH1A1
Allylbenzene SCHEMBL28198945 0.90 MAOB (0.55) MAOBCYP3A4TP53SMN1; SMN2ALDH1A1
Allylbenzene SCHEMBL2478260 0.90 MAOB (0.60) MAOBCYP3A4TP53SMN1; SMN2ALDH1A1
Allylbenzene SCHEMBL21274 0.90
Allylbenzene SCHEMBL10325179 0.90 MAOB (0.60) MAOBCYP3A4TP53SMN1; SMN2ALDH1A1
Allylbenzene SCHEMBL28635869 0.88 MAOB (0.52) MAOBCYP3A4TP53SMN1; SMN2ALDH1A1
Allylbenzene SCHEMBL28644650 0.88 MAOB (0.52) MAOBCYP3A4TP53SMN1; SMN2ALDH1A1
Allylbenzene SCHEMBL27379989 0.88 MAOB (0.52) MAOBCYP3A4TP53SMN1; SMN2ALDH1A1
Allylbenzene SCHEMBL27570402 0.88 MAOB (0.52) MAOBCYP3A4TP53SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115461390-B Spherical polyether/polysiloxane crosslinked rubber particles, polyether/polysiloxane crosslinked composite particles, and method for producing these particles 信越化学工业株式会社 2024-03-01 CN disclosed
US-20200318030-A1 FABRICATION FLUIDS HYDRANT INT TRADING CO LTD (TW) 2020-10-08 US disclosed
EP-3694961-A1 FABRICATION FLUIDS Hydrant International Trading Co. Ltd. (TW) 2020-08-19 EP disclosed
WO-2019074814-A1 FABRICATION FLUIDS HYDRANT INTERNATIONAL TRADING CO., LTD. (TW) 2019-04-18 WO disclosed
US-20170056698-A1 FIRE EXTINGUISHING COMPOSITIONS HYDRANT INTERNATIONAL TRADING CO., LTD. (TW) 2017-03-02 US disclosed
CN-106457013-A Fire extinguishing composition 消防栓国际贸易有限公司 2017-02-22 CN disclosed
CN-101203600-B Methods and means for protecting the skin against pathogenic microorganisms ORGANOBALANCE GMBH 2015-05-13 CN disclosed
CN-101547700-A Compositions, kits and uses for protecting the skin against pathogenic microorganisms ORGANOBALANCE GMBH (DE) 2009-09-30 CN disclosed
CN-101203600-A Methods and means for protecting the skin against pathogenic microorganisms ORGANOBALANCE GMBH (DE) 2008-06-18 CN disclosed
CN-1020933-C COMPOSITIONS AND METHODS THAT INTRADUCE VARIATIONS IN COLOR DENSITY INTO CELLULOSIC FABRICS, PARTICULARLY INDIGO DYED DENIM ECOLAB INC (US) 1993-05-26 CN disclosed
CN-1032551-A Make the cellulose base fiber fabric particularly composition and the method for the denim generation colour density variation of indigo dyeing ECOLAB INC (US) 1989-04-26 CN disclosed