SCHEMBL5049765

SCHEMBL5049765

CCCCCCCCC[C](C)CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.50
CES1 P23141 3/20 0.50
GPR84 Q9NQS5 7/20 0.48
PPARG P37231 7/20 0.48
PPARD Q03181 7/20 0.48
PPARA Q07869 7/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 5/20 0.48
PTPN1 P18031 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
FABP4 P15090 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
MEN1 O00255 1/20 0.48
ESR1 P03372 1/20 0.48
ALOX15 P16050 1/20 0.48
PDE4A P27815 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL10493580 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL4618899 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL6266733 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL10579757 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL8618244 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL4543213 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL3887573 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL9314471 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL10424078 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL6265728 1.00 CES2 (0.50) CES2CES1GPR84PPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008009680-A1 NOVEL HYDROGEN-RICH 1,3-DIALKOXYDISILOXANES AND PROCESSES FOR THEIR PREPARATION AND THEIR USE TECHNISCHE UNIVERSITÄT BERGAKADEMIE FREIBERG (DE) 2008-01-24 WO claimed
EP-0296199-A1 HETEROCYCLIC COMPOUNDS FOR TRANSDERMAL USE RAJADHYAKSHA, Vithal J. (US) 1988-12-28 EP claimed
WO-1988004938-A1 HETEROCYCLIC COMPOUNDS FOR TRANSDERMAL USE RAJADHYAKSHA VITHAL J (US) 1988-07-14 WO claimed
CN-106892915-B Organic compound, organic electroluminescence device and its application 南京高光半导体材料有限公司 2019-02-22 CN disclosed
EP-2723843-B1 USE OF WASHING OR CLEANING AGENTS HAVING INCREASED CLEANING PERFORMANCE HENKEL AG & CO KGAA (DE) 2016-11-16 EP disclosed
EP-2723843-A1 WASHING OR CLEANING AGENT HAVING INCREASED CLEANING PERFORMANCE Henkel AG & Co. KGaA (DE) 2014-04-30 EP disclosed
WO-2012175399-A1 WASHING OR CLEANING AGENT HAVING INCREASED CLEANING PERFORMANCE HENKEL AG & CO. KGAA (DE) 2012-12-27 WO disclosed
WO-2008009680-A1 NOVEL HYDROGEN-RICH 1,3-DIALKOXYDISILOXANES AND PROCESSES FOR THEIR PREPARATION AND THEIR USE TECHNISCHE UNIVERSITÄT BERGAKADEMIE FREIBERG (DE) 2008-01-24 WO disclosed
US-4892680-A OXIDATION RESISTANCE NIPPON OIL CO., LTD. (JP) 1990-01-09 US disclosed
EP-0305114-A1 Heat treating oil NIPPON OIL CO. LTD. (JP) 1989-03-01 EP disclosed
US-4737297-A MONO-SUBSTITUTED NAPHTHALENES NIPPON OIL CO., LTD. (JP) 1988-04-12 US disclosed
US-4665275-A OXIDATION-RESISTANT NAPHTHALENE DERIVATIVE NIPPON OIL CO., LTD. (JP) 1987-05-12 US disclosed