SCHEMBL3682201

SCHEMBL3682201

CC(C)C1(c2ccc(O)cc2)CCC(C)(c2ccc(O)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 7/20 0.39
ESR1 P03372 5/20 0.39
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
OPRD1 P41143 1/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A3 Q01959 3/20 0.33
SLC6A2 P23975 1/20 0.33
PDE2A O00408 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
CYP2D6 P10635 1/20 0.31
GRIN1 Q05586 1/20 0.31
KCNH2 Q12809 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31

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
SCHEMBL4492789 0.84 ESR2 (0.52) ESR2ESR1PDCD1CD274MMP2
SCHEMBL1408477 0.80 ESR1 (0.39) ESR2ESR1MMP2MMP9SLC6A4
SCHEMBL9972164 0.76 ESR2 (0.38) ESR2ESR1PDCD1CD274MMP2
Phenol SCHEMBL4491407 0.76 CA12 (0.48) ESR2ESR1MMP2MMP9OPRD1
SCHEMBL5241008 0.76 ESR2 (0.60) ESR2ESR1MMP2MMP9OPRD1
SCHEMBL1495106 0.76 ESR2 (0.54) ESR2ESR1MMP2MMP9OPRD1
SCHEMBL3688763 0.75 ESR1 (0.50) ESR2ESR1OPRD1SLC6A4SLC6A3
SCHEMBL1516123 0.74 ESR2 (0.61) ESR2ESR1MMP2MMP9OPRD1
SCHEMBL9972158 0.74 ESR1 (0.36) ESR2ESR1SLC6A4SLC6A3SLC6A2
SCHEMBL8593394 0.73 ESR2 (0.40) ESR2ESR1PDCD1CD274MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8574745-B2 Resin composition and organic-electrolyte battery NISSAN MOTOR CO., LTD. (JP) 2013-11-05 US disclosed
US-8574745-B2 Resin composition and organic-electrolyte battery NISSAN MOTOR CO., LTD. (JP) 2013-11-05 US disclosed
US-20120156546-A1 RESIN COMPOSITION AND ORGANIC-ELECTROLYTE BATTERY NISSAN MOTOR CO., LTD. 2012-06-21 US disclosed
US-20120156546-A1 RESIN COMPOSITION AND ORGANIC-ELECTROLYTE BATTERY NISSAN MOTOR CO., LTD. 2012-06-21 US disclosed
US-20100036029-A1 POLYMER-(ORGANO)CLAY COMPOSITE, COMPOSITION COMPRISING THE COMPOSITE, SHEET-LIKE MATERIAL COMPRISING THE COMPOSITE OR THE COMPOSITION, AND PROCESS FOR PRODUCTION OF POLYMER-(ORGANO)CLAY COMPOSITE ASAHI KASEI CHEMICALS CORPORATION (JP) 2010-02-11 US disclosed
EP-2113526-A1 POLYMER-(ORGANO)CLAY COMPLEX, COMPOSITION COMPRISING THE COMPLEX, SHEET-LIKE MATERIAL COMPRISING THE COMPLEX OR COMPOSITION, AND METHOD FOR PRODUCTION OF POLYMER-(ORGANO)CLAY COMPLEX Asahi Kasei Chemicals Corporation (JP) 2009-11-04 EP disclosed
EP-1479710-A1 Production of polymer compounds between polyester and diamine, a polymer compound and a structure including thereof M & S Research and Development Co., Ltd. (JP) 2004-11-24 EP disclosed
US-20040214959-A1 Production of polymer compounds between polyester and diamine, a polymer compound and a structure including thereof M&S RESEARCH AND DEVELOPMENT CO., LTD. (JP) 2004-10-28 US disclosed
EP-0884342-B1 Resin for coating formation and method for producing the same UNITIKA LTD (JP) 2003-09-24 EP disclosed
US-5902872-A POLYARYLATE COMPRISING 2,2-BIS/3-METHYL-4-HYDROXYPHENYL/PROPANE UNITS, TEREPHTHALIC ACID UNITS AND ISOPHTHALIC ACID UNITS, HAVING SPECIFIED INHERENT VISCOSITY UNITIKA, LTD. (JP) 1999-05-11 US disclosed
EP-0884342-A1 Resin for coating formation and method for producing the same UNITIKA LTD. (JP) 1998-12-16 EP disclosed