SCHEMBL7135772

SCHEMBL7135772

CCc1cc(O)c(C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)cc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.57
PTPN1 P18031 2/20 0.57
MAOB P27338 6/20 0.54
APP P05067 3/20 0.54
CNR1 P21554 2/20 0.52
CNR2 P34972 2/20 0.52
TRPV1 Q8NER1 2/20 0.52
PTGES O14684 1/20 0.51
ALOX5 P09917 1/20 0.51
PTGS1 P23219 1/20 0.51
PTGS2 P35354 1/20 0.51
OSBP P22059 1/20 0.51
SLC6A3 Q01959 2/20 0.50
PPARG P37231 2/20 0.50
TRPM7 Q96QT4 1/20 0.50
DAGLA Q9Y4D2 1/20 0.50
PPARA Q07869 1/20 0.50
TRPA1 O75762 1/20 0.50
INHA P05111 1/20 0.50
SLC6A2 P23975 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
SCHEMBL9714237 0.92 PTPN1 (0.61) BACE1PTPN1MAOBAPPCNR1
SCHEMBL9714250 0.92 PTPN1 (0.61) BACE1PTPN1MAOBAPPCNR1
SCHEMBL7048803 0.86 MAOB (0.63) BACE1PTPN1MAOBAPPCNR1
SCHEMBL7080850 0.86 MAOB (0.63) BACE1PTPN1MAOBAPPCNR1
Cymopol SCHEMBL8649278 0.83 BACE1 (0.52) BACE1PTPN1MAOBAPPCNR1
Cymopol SCHEMBL21055681 0.83 BACE1 (0.52) BACE1PTPN1MAOBAPPCNR1
Cymopol SCHEMBL29378158 0.83 BACE1 (0.52) BACE1PTPN1MAOBAPPCNR1
SCHEMBL7140643 0.82 BACE1 (0.64) BACE1PTPN1MAOBAPPCNR1
SCHEMBL14248819 0.81 MAOB (0.65) BACE1PTPN1MAOBAPPCNR1
SCHEMBL15970570 0.81 MAOB (0.65) BACE1PTPN1MAOBAPPCNR1

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
WO-2003080844-A2 ENHANCEMENT OF VITAMIN E CONTENT IN ORGANISMS BY ENHANCING 2-METHYL-6-PHYTYL HYDROQUINONE-METHYLTRANSFERASE ACTIVITY SUNGENE GMBH & CO KGAA (DE) 2003-10-02 WO disclosed