Styrene

Styrene

SCHEMBL9018583

C=C(C)C(=O)O.C=CC(=C)C.C=CC(=O)O.C=Cc1ccccc1

nearest known ligand 0.50

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
TSHR P16473 3/20 0.50
AKR1C3 P42330 1/20 0.44
HTT P42858 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
GLA P06280 1/20 0.40
AKT1 P31749 1/20 0.38
HDAC3 O15379 1/20 0.38
TNKS O95271 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38

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 SCHEMBL9192077 0.96 ALDH1A1 (0.54) ALDH1A1TSHRAKR1C3HTTTDP1
Styrene SCHEMBL9064452 0.96 ALDH1A1 (0.54) ALDH1A1TSHRAKR1C3HTTTDP1
Styrene SCHEMBL3442410 0.96 ALDH1A1 (0.54) ALDH1A1TSHRAKR1C3HTTTDP1
Styrene SCHEMBL8700333 0.96 ALDH1A1 (0.54) ALDH1A1TSHRAKR1C3HTTTDP1
Styrene SCHEMBL9219854 0.95 ALDH1A1 (0.52) ALDH1A1TSHRAKR1C3HTTTDP1
Styrene SCHEMBL9018594 0.94 ALDH1A1 (0.56) ALDH1A1TSHRAKR1C3HTTTDP1
Styrene SCHEMBL1562577 0.94 ALDH1A1 (0.56) ALDH1A1TSHRAKR1C3HTTTDP1
Styrene SCHEMBL22396598 0.93 ALDH1A1 (0.50) ALDH1A1TSHRAKR1C3HTTTDP1
Styrene SCHEMBL10482120 0.93 ALDH1A1 (0.50) ALDH1A1TSHRAKR1C3HTTTDP1
Styrene SCHEMBL76985 0.91 ALDH1A1 (0.61) ALDH1A1TSHRAKR1C3HTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5585215-A Toner compositions XEROX CORPORATION (US) 1996-12-17 US claimed
US-5585215-A Toner compositions XEROX CORPORATION (US) 1996-12-17 US disclosed