Styrene

Styrene

SCHEMBL7718196

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

nearest known ligand 0.47

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.47
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.44
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.37
GLA P06280 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP2C9 P11712 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RECQL P46063 1/20 0.35
PTGS2 P35354 1/20 0.35
NPC1 O15118 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 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 SCHEMBL293504 0.95 AKR1C3 (0.52) AKR1C3ALDH1A1TSHRHTTGLA
Styrene SCHEMBL8068589 0.95 AKR1C3 (0.52) AKR1C3ALDH1A1TSHRHTTGLA
Styrene SCHEMBL9879337 0.92 AKR1C3 (0.49) AKR1C3ALDH1A1TSHRHTTGLA
Styrene SCHEMBL3665393 0.92 AKR1C3 (0.49) AKR1C3ALDH1A1TSHRHTTGLA
Styrene SCHEMBL238869 0.88 AKR1C3 (0.59) AKR1C3ALDH1A1TSHRHTTMAPT
Styrene SCHEMBL134355 0.88 AKR1C3 (0.59) AKR1C3ALDH1A1TSHRHTTMAPT
Styrene SCHEMBL9507947 0.87 AKR1C3 (0.53) AKR1C3ALDH1A1TSHRHTTMAPT
Styrene SCHEMBL6471967 0.87 AKR1C3 (0.44) AKR1C3ALDH1A1TSHRHTTMAPT
Styrene SCHEMBL8352287 0.85 AKR1C3 (0.42) AKR1C3ALDH1A1TSHRHTTMAPT
Styrene SCHEMBL9630667 0.85 AKR1C3 (0.52) AKR1C3ALDH1A1TSHRHTTMAPT

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-6380297-B1 DISSOLVING IN SOLVENT; DISPERSION; HOMOGENIZING; ADDING SURFACTANT; DESOLVENTIZING NEXPRESS SOLUTIONS LLC 2002-04-30 US claimed
US-5750307-A SYNTHETIC FIBERS EASTMAN KODAK COMPANY (US) 1998-05-12 US disclosed