Styrene

Styrene

SCHEMBL7730624

C/C(=C\CCO)C(=O)O.C/C(=C\Cc1ccccc1)C(=O)O.C=CC(=O)O.C=Cc1ccccc1

nearest known ligand 0.39

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 4/20 0.39
CYP2C9 P11712 3/20 0.35
ALDH1A1 P00352 3/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP3A4 P08684 2/20 0.33
PPARG P37231 1/20 0.32
CYP2C19 P33261 1/20 0.32
BACE1 P56817 1/20 0.31
AKR1C2 P52895 2/20 0.31
AKR1C4 P17516 2/20 0.31
TOP1 P11387 1/20 0.31
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
TBXAS1 P24557 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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 SCHEMBL21113739 0.93 AKR1C3 (0.39) AKR1C3CYP2C9ALDH1A1TSHRHTT
Styrene SCHEMBL5725939 0.88 AKR1C3 (0.49) AKR1C3CYP2C9ALDH1A1TSHRHTT
Styrene SCHEMBL5662638 0.88 AKR1C3 (0.49) AKR1C3CYP2C9ALDH1A1TSHRHTT
Styrene SCHEMBL9256347 0.88 AKR1C3 (0.49) AKR1C3CYP2C9ALDH1A1TSHRHTT
Acrylic Acid SCHEMBL2912970 0.85 CYP2C9 (0.45) AKR1C3CYP2C9ALDH1A1HTTNPC1
Methacrylic Acid SCHEMBL3241427 0.84 CYP2C9 (0.40) AKR1C3CYP2C9ALDH1A1NPC1RAB9A
Styrene SCHEMBL5340494 0.84 AKR1C3 (0.45) AKR1C3CYP2C9ALDH1A1TSHRHTT
Styrene SCHEMBL829551 0.84 AKR1C3 (0.45) AKR1C3CYP2C9ALDH1A1TSHRHTT
Styrene SCHEMBL5669191 0.84 AKR1C3 (0.45) AKR1C3CYP2C9ALDH1A1TSHRHTT
Styrene SCHEMBL4347653 0.83 AKR1C3 (0.33) AKR1C3CYP2C9ALDH1A1HTTAKR1C2

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-6414733-B1 Color liquid crystal display with a shielding member being arranged between sealing member and display zone DAI NIPPON PRINTING CO., LTD. (JP) 2002-07-02 US disclosed