SCHEMBL4634142

SCHEMBL4634142

C=CCc1ccc(O)c2c1CCO2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.46
GABRB2 P47870 4/20 0.46
POLB P06746 2/20 0.41
MAPT P10636 3/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 2/20 0.38
CNR1 P21554 2/20 0.38
CNR2 P34972 2/20 0.38
KMT2A Q03164 2/20 0.38
ALOX5 P09917 1/20 0.38
GABRB1 P18505 1/20 0.38
RXRA P19793 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
SIRT3 Q9NTG7 1/20 0.38
AKR1B1 P15121 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37

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
SCHEMBL1647548 0.87 GABRA1 (0.46) GABRA1GABRB2POLBMAPTMEN1
SCHEMBL2641549 0.77 GABRA1 (0.52) GABRA1GABRB2POLBMAPTMEN1
SCHEMBL30700587 0.75 GABRA1 (0.50) GABRA1GABRB2POLBMAPTMEN1
SCHEMBL11667886 0.74 CYP3A4 (0.33) GABRA1GABRB2POLBMAPTSRD5A1
SCHEMBL461683 0.73 CYP3A4 (0.37) GABRA1GABRB2POLBMAPTALDH1A1
SCHEMBL9606474 0.72 CYP3A4 (0.31) GABRA1GABRB2MAPTCYP1A2CYP3A4
SCHEMBL11809717 0.72 POLB (0.39) GABRA1GABRB2POLBMAPTMEN1
SCHEMBL370147 0.71 SRD5A1 (0.41) GABRA1GABRB2POLBMAPTMEN1
SCHEMBL6037106 0.71 TYR (0.49) MAPTMEN1KMT2AALOX5ALDH1A1
Sulfuric Acid SCHEMBL9689209 0.70 POLB (0.35) POLBMAPTCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1552813-B1 Hair dyeing composition comprising a fluorindinium compound. OREAL (FR) 2008-03-12 EP claimed
EP-0475664-B1 Lubricant composition and use thereof DOW CORNING SA (FR) 1993-11-10 EP disclosed
EP-0552270-A1 TREATMENT OF FIBRE COURTAULDS PLC (GB) 1993-07-28 EP disclosed
WO-1992007124-A1 TREATMENT OF FIBRE COURTAULDS PLC (GB) 1992-04-30 WO disclosed
EP-0475664-A1 Lubricant composition and use thereof Dow Corning France S.A. (FR) 1992-03-18 EP disclosed