Chavicol

Chavicol

SCHEMBL5489418

C=CCc1ccc(O)cc1.[LiH]

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.56
ALDH1A1 P00352 5/20 0.54
GABRA1 P14867 3/20 0.54
GABRB2 P47870 3/20 0.54
MEN1 O00255 2/20 0.54
GAA P10253 2/20 0.54
MAPT P10636 2/20 0.54
CNR1 P21554 2/20 0.54
CNR2 P34972 2/20 0.54
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 2/20 0.54
PPARG P37231 2/20 0.54
PPARD Q03181 2/20 0.54
ALDH2 P05091 1/20 0.54
AKR1B1 P15121 1/20 0.54
HPGD P15428 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
CYP3A4 P08684 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
TP53 P04637 1/20 0.50

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
Chavicol SCHEMBL30870 0.97 XDH (0.58) XDHALDH1A1GABRA1GABRB2MEN1
Chavicol SCHEMBL10902352 0.95 XDH (0.56) XDHALDH1A1GABRA1GABRB2MEN1
Chavicol SCHEMBL5483528 0.95 XDH (0.56) XDHALDH1A1GABRA1GABRB2MEN1
Chavicol SCHEMBL28830232 0.95 XDH (0.56) XDHALDH1A1GABRA1GABRB2MEN1
Chavicol SCHEMBL10511637 0.95 XDH (0.56) XDHALDH1A1GABRA1GABRB2MEN1
Chavicol SCHEMBL10565597 0.95 XDH (0.56) XDHALDH1A1GABRA1GABRB2MEN1
Chavicol SCHEMBL11043594 0.95 XDH (0.56) XDHALDH1A1GABRA1GABRB2MEN1
Chavicol SCHEMBL7924978 0.95 XDH (0.56) XDHALDH1A1GABRA1GABRB2MEN1
Chavicol SCHEMBL7187339 0.95 XDH (0.56) XDHALDH1A1GABRA1GABRB2MEN1
Chavicol SCHEMBL10824283 0.95 XDH (0.56) XDHALDH1A1GABRA1GABRB2MEN1

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-7252927-B2 High performance curable polymers and processes for the preparation thereof XEROX CORPORATION (US) 2007-08-07 US claimed