SCHEMBL532205

SCHEMBL532205

CCCc1ccc(OCC)c(O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.53
CNR2 P34972 1/20 0.53
GABRA1 P14867 2/20 0.52
GABRB2 P47870 2/20 0.52
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
NFKB1 P19838 1/20 0.50
CALM1 P0DP23 1/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.49
APEX1 P27695 1/20 0.49
TUBB4A P04350 1/20 0.47
TUBB P07437 1/20 0.47
TUBA3C P0DPH7 1/20 0.47
TUBA1B P68363 1/20 0.47
TUBA4A P68366 1/20 0.47
TUBB4B P68371 1/20 0.47
TUBB3 Q13509 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
SCHEMBL11022505 0.87 KDM4E (0.55) CYP1A2CYP3A4TSHRNFKB1CALM1
SCHEMBL16315989 0.87 CNR1 (0.52) CNR1CNR2GABRA1GABRB2CYP1A2
SCHEMBL426433 0.85 CNR1 (0.58) CNR1CNR2GABRA1GABRB2TSHR
SCHEMBL10757057 0.85 TRPA1 (0.57) CYP1A2CYP3A4TSHRNFKB1CALM1
Hydrochloric Acid SCHEMBL11548357 0.84 LMNA (0.71) CYP1A2CYP3A4TSHRNFKB1MEN1
SCHEMBL27182628 0.84 CALM1 (0.56) CYP1A2CYP3A4TSHRNFKB1CALM1
SCHEMBL16978333 0.84 CNR1 (0.49) CNR1CNR2GABRA1GABRB2CYP1A2
SCHEMBL29833121 0.83 CYP3A4 (0.71) CNR1CNR2GABRA1GABRB2CYP1A2
SCHEMBL901444 0.83 CYP3A4 (0.71) CNR1CNR2GABRA1GABRB2CYP1A2
SCHEMBL623585 0.82 CALM1 (0.57) GABRA1GABRB2CYP1A2CYP3A4TSHR

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1832979-A Polyester process using a pipe reactor EASTMAN CHEM CO (US) 2006-09-13 CN claimed
CN-1205728-A Polyester/polyamide blend having improved flavor retaining property and clarity EASTMAN CHEM CO (US) 1999-01-20 CN claimed
CN-104672822-A Polyester compositions LANXESS DEUTSCHLAND GMBH 2015-06-03 CN disclosed
CN-104672820-A Polyester Compounds LANXESS DEUTSCHLAND GMBH 2015-06-03 CN disclosed
CN-104672819-A Polyester compositions LANXESS DEUTSCHLAND GMBH 2015-06-03 CN disclosed
CN-101796115-B Thermally conductive and electrically insulating thermoplastic hybrid material LANXESS DEUTSCHLAND GMBH 2012-09-19 CN disclosed
CN-101263185-B Method for addition of additives into a polymer melt EASTMAN CHEM CO 2012-05-02 CN disclosed
EP-1116446-B1 Method for improving shelf life and / or stability of products which may spoil by the influence of microbes SCHUER JOERG-PETER (DE) 2012-02-08 EP disclosed
CN-101796115-A Thermally conductive and electrically insulating thermoplastic hybrid material LANXESS DEUTSCHLAND GMBH 2010-08-04 CN disclosed
CN-101263185-A Method for addition of additives into a polymer melt EASTMAN CHEM CO (US) 2008-09-10 CN disclosed
CN-1832979-A Polyester process using a pipe reactor EASTMAN CHEM CO (US) 2006-09-13 CN disclosed
EP-0991318-A1 ADDITIVE FOR IMPROVING THE STORAGE LIFE OF AND/OR STABILISING MICROBIALLY PERISHABLE PRODUCTS Schür, Jörg-Peter (DE) 2000-04-12 EP disclosed
CN-1247740-A Water solution composition containing sulfonated polyester mixture OREAL (FR) 2000-03-22 CN disclosed
CN-1205728-A Polyester/polyamide blend having improved flavor retaining property and clarity EASTMAN CHEM CO (US) 1999-01-20 CN disclosed
WO-1998058540-A1 ADDITIVE FOR IMPROVING THE STORAGE LIFE OF AND/OR STABILISING MICROBIALLY PERISHABLE PRODUCTS SCHUER JOERG PETER (DE) 1998-12-30 WO disclosed
EP-0762837-A1 PROCESS FOR IMPROVING THE SHELF LIFE OF AND/OR STABILISING PRODUCTS WHICH CAN SPOIL UNDER THE ACTION OF MICROBES Schür, Jörg-Peter (DE) 1997-03-19 EP disclosed
WO-1996029895-A1 PROCESS FOR IMPROVING THE SHELF LIFE OF AND/OR STABILISING PRODUCTS WHICH CAN SPOIL UNDER THE ACTION OF MICROBES SCHUER JOERG PETER (DE) 1996-10-03 WO disclosed
EP-0179532-B1 PERFUME COMPOSITION AND PERFUMED PRODUCTS WHICH CONTAIN ONE OR MORE O-ALKOXYPHENOLS AS PERFUME COMPONENT NAARDEN INTERNATIONAL N.V. (NL) 1987-08-19 EP disclosed
US-4650604-A VANILLA NAARDEN INTERNATIONAL N. V. (NL) 1987-03-17 US disclosed
EP-0179532-A1 Perfume composition and perfumed products which contain one or more o-alkoxyphenols as perfume component NAARDEN INTERNATIONAL N.V. (NL) 1986-04-30 EP disclosed