SCHEMBL8601201

SCHEMBL8601201

c1ccc(COc2ccc(OC3CCCO3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
CYP1A2 P05177 1/20 0.47
PTGS1 P23219 1/20 0.47
SLC6A2 P23975 1/20 0.47
CYP2C19 P33261 1/20 0.47
PTGS2 P35354 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HIF1A Q16665 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
MAOB P27338 4/20 0.46
MAOA P21397 2/20 0.46
RAB9A P51151 2/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FDFT1 P37268 2/20 0.46
LTA4H P09960 1/20 0.44
FOXM1 Q08050 1/20 0.44
BCHE P06276 1/20 0.44

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
SCHEMBL8601010 0.96 LMNA (0.46) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL31473767 0.92 CYP1A2 (0.51) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL19556828 0.92 DHFR (0.45) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL6768580 0.86 SRD5A2 (0.56) MAOBRAB9AGAAMAPTSMN1; SMN2
SCHEMBL27252707 0.83 DHFR (0.54) MAOBMAOABCHEHRH3CYP2D6
SCHEMBL18354376 0.83 APP (0.46) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8601204 0.82 CCR5 (0.45) SLC6A2SLC6A3GAAMAPTL3MBTL1
SCHEMBL7157475 0.82 HRH1 (0.41) LMNASLC6A2SLC6A3RAB9AGAA
SCHEMBL19504842 0.81 FFAR1 (0.50) RAB9ASMN1; SMN2LTA4HHRH3
SCHEMBL25221323 0.81 KMT2A (0.57) LMNACYP1A2PTGS1SLC6A2CYP2C19

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
US-5811593-A MADE BY REACTING HYDROQUINONE MONOETHER WITH ENOL ETHER IN PRESENCE OF ACID CATALYST, REACTING PRODUCT WITH HYDROGEN TRANSFER AGENT IN PRESENCE OF METAL CATALYST TO CLEAVE PROTECTING GROUP THE PROCTER & GAMBLE COMPANY (US) 1998-09-22 US disclosed
EP-0748306-A1 PROCESS FOR MAKING MONOACETALS OF HYDROQUINONE THE PROCTER & GAMBLE COMPANY (US) 1996-12-18 EP disclosed
US-5585525-A Process for making monoacetals of hydroquinone THE PROCTER & GAMBLE COMPANY (US) 1996-12-17 US disclosed
WO-1995023779-A2 PROCESS FOR MAKING MONOACETALS OF HYDROQUINONE THE PROCTER & GAMBLE COMPANY (US) 1995-09-08 WO disclosed
WO-1995023778-A2 PROCESS FOR MAKING MONOACETALS OF HYDROQUINONE THE PROCTER & GAMBLE COMPANY (US) 1995-09-08 WO disclosed