SCHEMBL11261537

SCHEMBL11261537

[CH2]c1cc(CC=C)cc(CC=C)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.42
TNKS O95271 2/20 0.42
PARP1 P09874 1/20 0.42
GABRA1 P14867 8/20 0.41
GABRB2 P47870 8/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
GAA P10253 2/20 0.41
MAPT P10636 2/20 0.41
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
ALDH2 P05091 1/20 0.41
AKR1B1 P15121 1/20 0.41
HPGD P15428 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL2461750 0.87 XDH (0.48) XDHTNKSPARP1GABRA1GABRB2
SCHEMBL11660795 0.82 DHFR (0.46) XDHTNKSPARP1GABRA1GABRB2
SCHEMBL9319191 0.82 TNKS (0.56) XDHTNKSPARP1GABRA1GABRB2
SCHEMBL9285299 0.80 XDH (0.42) XDHTNKSPARP1GABRA1GABRB2
SCHEMBL27771899 0.78 SHBG (0.48) XDHTNKSPARP1GABRA1GABRB2
SCHEMBL18657227 0.78 GABRA1 (0.52) XDHTNKSPARP1GABRA1GABRB2
SCHEMBL9285307 0.78 XDH (0.41) XDHTNKSPARP1GABRA1GABRB2
SCHEMBL9703377 0.78 XDH (0.41) XDHTNKSPARP1GABRA1GABRB2
SCHEMBL822357 0.77 TNKS (0.40) XDHTNKSPARP1GABRA1GABRB2
SCHEMBL9453990 0.77 TNKS (0.41) XDHTNKSPARP1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4319052-A Method for preparing sterically hindered bis- or polyphenols STYSKIN EVGENY L 1982-03-09 US claimed
US-4319052-A Method for preparing sterically hindered bis- or polyphenols STYSKIN EVGENY L 1982-03-09 US disclosed
US-4319052-A Method for preparing sterically hindered bis- or polyphenols STYSKIN EVGENY L 1982-03-09 US disclosed