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Styrene

Styrene

SCHEMBL11068282

C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=CCS(=O)(=O)O.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1.C=Cc1ccccc1

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.54
▸ TSHR P16473 3/20 0.54
▸ TDP1 Q9NUW8 1/20 0.47
▸ LMNA P02545 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ PSMD14 O00487 1/20 0.35
▸ CYP2C19 P33261 1/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.33
▸ PAM P19021 1/20 0.33
▸ CYP2A6 P11509 1/20 0.33
▸ MMP9 P14780 1/20 0.33
▸ GAA P10253 1/20 0.33

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 SCHEMBL4557949 1.00 ALDH1A1 (0.54) ALDH1A1TSHRTDP1LMNAMAPT
Styrene SCHEMBL11159152 0.84 ALDH1A1 (0.58) ALDH1A1TSHRTDP1LMNAMAPT
Styrene SCHEMBL10931561 0.84 ALDH1A1 (0.58) ALDH1A1TSHRTDP1LMNAMAPT
Styrene SCHEMBL4587092 0.84 ALDH1A1 (0.58) ALDH1A1TSHRTDP1LMNAMEN1
Biphenyl SCHEMBL10561027 0.84 ALDH1A1 (0.40) ALDH1A1TSHRLMNAMAPTMEN1
Styrene SCHEMBL1261405 0.83 ALDH1A1 (0.70) ALDH1A1TSHRTDP1LMNAMAPT
Benzene SCHEMBL6408353 0.83 ALDH1A1 (0.35) ALDH1A1TSHRTDP1LMNAMAPT
Phenol SCHEMBL1792651 0.82 ESR1 (0.45) ALDH1A1TSHRTDP1LMNAMAPT
SCHEMBL17310264 0.82 PPARG (0.41) ALDH1A1LMNAHTTKMT2APAM
Naphthalene SCHEMBL27669760 0.82 ALDH1A1 (0.45) ALDH1A1TSHRTDP1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4437861-A POLYMERS WITH HYDROPHILIC AND HYDROPHOBIC MONOMERS DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1984-03-20 — — US disclosed