SCHEMBL4019837

SCHEMBL4019837

C=CCc1ccc(O)c(OC)c1OCC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 7/20 0.44
GABRB2 P47870 7/20 0.44
TRPM8 Q7Z2W7 4/20 0.43
ALOX5 P09917 2/20 0.43
CYP3A4 P08684 2/20 0.43
ALDH1A1 P00352 1/20 0.43
AR P10275 1/20 0.43
PTGS1 P23219 1/20 0.43
KDM4E B2RXH2 1/20 0.40
PTPN1 P18031 1/20 0.40
CNR2 P34972 2/20 0.40
ALOX15 P16050 1/20 0.37
TUBB1 Q9H4B7 1/20 0.37
POLB P06746 1/20 0.36
CNR1 P21554 1/20 0.36
TRPA1 O75762 1/20 0.36

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
SCHEMBL310587 0.89 ALOX5 (0.49) GABRA1GABRB2TRPM8ALOX5CYP3A4
SCHEMBL28222028 0.82 CYP3A4 (0.46) GABRA1GABRB2TRPM8ALOX5CYP3A4
SCHEMBL6672329 0.81 GABRA1 (0.47) GABRA1GABRB2ALDH1A1KDM4EPTPN1
SCHEMBL1050164 0.80 CYP3A4 (0.47) GABRA1GABRB2TRPM8ALOX5CYP3A4
SCHEMBL1173287 0.79 ALOX5 (0.44) GABRA1GABRB2TRPM8ALOX5CYP3A4
SCHEMBL16182030 0.79 KDM4E (0.44) GABRA1GABRB2TRPM8ALOX5CYP3A4
SCHEMBL11883052 0.79 TUBB1 (0.42) ALDH1A1KDM4ETUBB1
Ether SCHEMBL28727008 0.79 TRPM8 (0.41) GABRA1GABRB2TRPM8ALOX5CYP3A4
SCHEMBL1869397 0.79 ALOX5 (0.46) GABRA1GABRB2TRPM8ALOX5CYP3A4
SCHEMBL132917 0.79 ALOX5 (0.46) GABRA1GABRB2TRPM8ALOX5CYP3A4

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-2132294-A1 ACTIVE INGREDIENT CARRIER SYSTEMS Henkel AG & Co. KGaA (DE) 2009-12-16 EP disclosed
EP-2046929-A1 LIQUID SUPPORT Henkel AG & Co. KGaA (DE) 2009-04-15 EP disclosed
WO-2008104240-A1 ACTIVE INGREDIENT CARRIER SYSTEMS HENKEL AG & CO. KGAA (DE) 2008-09-04 WO disclosed
WO-2008055787-A1 FOAM SPONGE WITH STORAGE PARTICLES HENKEL AG & CO. KGAA (DE) 2008-05-15 WO disclosed
WO-2008012140-A1 LIQUID SUPPORT HENKEL AG & CO. KGAA (DE) 2008-01-31 WO disclosed