SCHEMBL7048803

SCHEMBL7048803

CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/Cc1cc(O)c(C)cc1O

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.63
APP P05067 4/20 0.63
BACE1 P56817 3/20 0.60
PTPN1 P18031 2/20 0.60
OSBP P22059 1/20 0.50
PPARG P37231 2/20 0.49
PPARA Q07869 2/20 0.49
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
KMT2A Q03164 1/20 0.47
PTGES O14684 1/20 0.47
ALOX5 P09917 1/20 0.47
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47

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
SCHEMBL7080850 1.00 MAOB (0.63) MAOBAPPBACE1PTPN1OSBP
SCHEMBL9714250 0.91 PTPN1 (0.61) MAOBAPPBACE1PTPN1OSBP
SCHEMBL9714237 0.91 PTPN1 (0.61) MAOBAPPBACE1PTPN1OSBP
SCHEMBL15970570 0.89 MAOB (0.65) MAOBAPPBACE1PTPN1OSBP
SCHEMBL14248819 0.89 MAOB (0.65) MAOBAPPBACE1PTPN1OSBP
SCHEMBL7135772 0.86 BACE1 (0.57) MAOBAPPBACE1PTPN1OSBP
Cymopol SCHEMBL21055681 0.82 BACE1 (0.52) MAOBAPPBACE1PTPN1OSBP
Cymopol SCHEMBL8649278 0.82 BACE1 (0.52) MAOBAPPBACE1PTPN1OSBP
Cymopol SCHEMBL29378158 0.82 BACE1 (0.52) MAOBAPPBACE1PTPN1OSBP
SCHEMBL8024047 0.81 BACE1 (0.62) MAOBAPPBACE1PTPN1OSBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030084479-A1 Homogentisate phytyl transferase SUNGENE GMBH & CO. KGAA (DE) 2003-05-01 US disclosed
EP-1299413-A2 HOMOGENTISATE PHYTYL TRANSFERASE Sungene GmbH & Co. KgAA (DE) 2003-04-09 EP disclosed
WO-2001062781-A2 HOMOGENTISATE PHYTYL TRANSFERASE SUNGENE GMBH & CO. KGAA (DE) 2001-08-30 WO disclosed