Styrene

Styrene

SCHEMBL28783262

C=C(C)C(=O)OC1CCCCC1.C=Cc1ccccc1.CCOC(N)=O

nearest known ligand 0.39

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
HPGD P15428 1/20 0.37
XBP1 P17861 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
TSHR P16473 1/20 0.35
CHRM2 P08172 2/20 0.35
CHRM4 P08173 2/20 0.35
CHRM5 P08912 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34

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 SCHEMBL3780614 0.89 FABP7 (0.41) MEN1KMT2AMAPTL3MBTL1ALDH1A1
Styrene SCHEMBL209795 0.86 TDP1 (0.39) MEN1KMT2AMAPTL3MBTL1ALDH1A1
Urethane SCHEMBL27799195 0.85 MEN1 (0.35) MEN1KMT2AMAPTL3MBTL1ALDH1A1
SCHEMBL7540243 0.80 TRPM8 (0.40) MEN1KMT2AMAPTALDH1A1HPGD
Styrene SCHEMBL1256040 0.79 MEN1 (0.53) MEN1KMT2AMAPTL3MBTL1ALDH1A1
Styrene SCHEMBL3895805 0.77 MEN1 (0.45) MEN1KMT2AMAPTL3MBTL1ALDH1A1
Styrene SCHEMBL4423746 0.77 MEN1 (0.50) MEN1KMT2AMAPTL3MBTL1ALDH1A1
Styrene SCHEMBL5865142 0.77 MEN1 (0.50) MEN1KMT2AMAPTL3MBTL1ALDH1A1
Styrene SCHEMBL142403 0.77 MEN1 (0.58) MEN1KMT2AMAPTL3MBTL1ALDH1A1
Styrene SCHEMBL7214028 0.76 MEN1 (0.49) MEN1KMT2AMAPTL3MBTL1ALDH1A1

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
CN-101695652-A Gas separation functional material and preparation method and application thereof UNIV FUDAN 2010-04-21 CN disclosed