Styrene

Styrene

SCHEMBL6471967

C=CC#N.C=Cc1ccccc1.CCC=C(C)C(=O)O

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.44
ALDH1A1 P00352 3/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.35
NPC1 O15118 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
RAB9A P51151 2/20 0.33
MAPT P10636 1/20 0.33
POLB P06746 1/20 0.33
CYP2C9 P11712 1/20 0.33
GLA P06280 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PTGS2 P35354 1/20 0.33
MCL1 Q07820 1/20 0.33
RECQL P46063 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31

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
Styrene SCHEMBL7043412 0.97 AKR1C3 (0.41) AKR1C3ALDH1A1TSHRHTTNPC1
Styrene SCHEMBL7043422 0.97 AKR1C3 (0.41) AKR1C3ALDH1A1TSHRHTTNPC1
Styrene SCHEMBL8068589 0.91 AKR1C3 (0.52) AKR1C3ALDH1A1TSHRHTTNPC1
Styrene SCHEMBL293504 0.91 AKR1C3 (0.52) AKR1C3ALDH1A1TSHRHTTNPC1
Styrene SCHEMBL9879337 0.88 AKR1C3 (0.49) AKR1C3ALDH1A1TSHRHTTNPC1
Styrene SCHEMBL3665393 0.88 AKR1C3 (0.49) AKR1C3ALDH1A1TSHRHTTNPC1
Styrene SCHEMBL7718196 0.87 AKR1C3 (0.47) AKR1C3ALDH1A1TSHRHTTNPC1
Styrene SCHEMBL8737030 0.86 AKR1C3 (0.41) AKR1C3ALDH1A1TSHRHTTNPC1
Styrene SCHEMBL301613 0.85 AKR1C3 (0.49) AKR1C3ALDH1A1TSHRHTTNPC1
Acrylonitrile SCHEMBL2118231 0.84 ALDH1A1 (0.36) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2964702-A1 HEAT CONDUCTING THERMOPLASTIC MOULDING COMPOSITIONS COMPRISING A FLAME RETARDANT BASF SE (DE) 2016-01-13 EP disclosed
WO-2014135624-A1 HEAT CONDUCTING THERMOPLASTIC MOULDING COMPOSITIONS COMPRISING A FLAME RETARDANT BASF SE (DE) 2014-09-12 WO disclosed
US-6927299-B2 FATTY ACID ESTERS COMPOSITION OF A POLYGLYCERINE, A PROCESS FOR THE PREPARATION THEREOF, A PROCESS FOR THE PREPARATION OF A HIGHLY-PURIFIED FATTY ACID ESTERS COMPOSITION OF A POLYGLYCERINE, A HIGHLY-PURIFIED FATTY ACID ESTERS COMPOSITION OF A POLYGLYCERINE, AN ADDITIVE FOR FOOD-STUFFS, A RESIN COMPOSITION, AND A COMPOSITION FOR COSMETICS OR DETERGENTS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-09 US disclosed
US-20040024233-A1 Fatty acid esters composition of a polyglycerine, a process for the preparation thereof, a process for the preparation of a highly-purified fatty acid esters composition of a polyglycerine, a highly-purified fatty acid esters composition of a polyglycerine, an additive for food-stuffs, a resin composition, and a composition for cosmetics or detergents ENDO TOSHIO (JP) 2004-02-05 US 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 (1 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-20040024233-A1 Fatty acid esters composition of a polyglycerine, a process for the preparation thereof, a process for the preparation of a highly-purified fatty acid esters composition of a polyglycerine, a highly-purified fatty acid esters composition of a polyglycerine, an additive for food-stuffs, a resin composition, and a composition for cosmetics or detergents FASN, DGAT2, SCD5 AKR1C3 1186/4885ALDH1A1 731/4885TSHR 3039/4885

“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.