SCHEMBL4449940

SCHEMBL4449940

CCCc1ccc(O)cc1OCC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.46
CNR2 P34972 9/20 0.44
CNR1 P21554 8/20 0.44
MEN1 O00255 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX5 P09917 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
CALM1 P0DP23 1/20 0.42
HMGCR P04035 1/20 0.42

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
SCHEMBL8147933 0.89 TYR (0.61) TYRCNR2CNR1MEN1TP53
SCHEMBL8139885 0.87 CNR2 (0.49) TYRCNR2CNR1MEN1TP53
SCHEMBL1049677 0.86 HTR2C (0.41) CNR2CNR1CYP3A4MAPTTSHR
SCHEMBL5884094 0.85 GABRA1 (0.52) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL13406987 0.83 HMGCR (0.56) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL9698367 0.83 CNR2 (0.62) TYRCNR2CNR1MEN1TP53
SCHEMBL5015511 0.82 POLB (0.51) CNR2CNR1
SCHEMBL4393909 0.81 ALDH1A1 (0.41) TYRMEN1MAPTKMT2ATDP1
SCHEMBL28282872 0.81 ALDH1A1 (0.41) TYRCNR2CNR1MEN1CYP3A4
SCHEMBL28480661 0.80 KMT2A (0.40) TYRCNR2CNR1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0033248-B1 MAGNETIC TONER AND METHOD FOR DEVELOPING USING SAME XEROX CORPORATION (US) 1986-03-19 EP claimed
US-20090306268-A1 Polyester Compositions Containing Metathesis Polymers with Reduced Recycle Color FIRESTONE POLYMERS, LLC 2009-12-10 US disclosed
EP-2001953-A1 POLYESTER COMPOSITIONS CONTAINING METATHESIS POLYMERS WITH REDUCED RECYCLE COLOR Firestone Polymers, LLC (US) 2008-12-17 EP disclosed
EP-1856205-A1 OXYGEN SCAVENGING POLYESTERS WITH REDUCED RECYCLE COLOR Firestone Polymers, LLC (US) 2007-11-21 EP disclosed
WO-2007100891-A1 POLYESTER COMPOSITIONS CONTAINING METATHESIS POLYMERS WITH REDUCED RECYCLE COLOR FIRESTONE POLYMERS, LLC (US) 2007-09-07 WO disclosed
WO-2006094060-A1 OXYGEN SCAVENGING POLYESTERS WITH REDUCED RECYCLE COLOR FIRESTONE POLYMERS, LLC (US) 2006-09-08 WO disclosed
CN-1130287-C laminated plastic molded body YOSHINO KOGYO CO LTD (JP) 2003-12-10 CN disclosed
CN-1353645-A Layered plastic molding YOSHINO KOGYOSHO CO INC (JP) 2002-06-12 CN disclosed
EP-0492237-A1 Modified polyester resins, process for their preparation and toner containing these polyester resins BAYER AG (DE) 1992-07-01 EP disclosed