SCHEMBL6053045

SCHEMBL6053045

C=NC(=O)CCCCCCCCCCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 6/20 0.54
CES2 O00748 5/20 0.54
GPR84 Q9NQS5 7/20 0.52
PPARG P37231 7/20 0.52
PPARD Q03181 7/20 0.52
PPARA Q07869 7/20 0.52
HDAC11 Q96DB2 5/20 0.52
TSHR P16473 4/20 0.52
PTPN1 P18031 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
FABP4 P15090 2/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
MEN1 O00255 1/20 0.52
ESR1 P03372 1/20 0.52
ALOX15 P16050 1/20 0.52
PDE4A P27815 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL13849591 1.00 CES1 (0.54) CES1CES2GPR84PPARGPPARD
SCHEMBL29005878 1.00 CES1 (0.54) CES1CES2GPR84PPARGPPARD
SCHEMBL8100856 1.00 CES1 (0.54) CES1CES2GPR84PPARGPPARD
SCHEMBL24104285 1.00 CES1 (0.54) CES1CES2GPR84PPARGPPARD
SCHEMBL18132978 1.00 CES1 (0.54) CES1CES2GPR84PPARGPPARD
SCHEMBL25030589 1.00 CES1 (0.54) CES1CES2GPR84PPARGPPARD
SCHEMBL16011355 0.88 FAAH (0.61) CES1PPARGPPARDPPARAPTPN1
SCHEMBL19704926 0.88 FAAH (0.61) CES1PPARGPPARDPPARAPTPN1
SCHEMBL20684910 0.87 KMT2A (0.55) CES1CES2GPR84PPARGPPARD
SCHEMBL16011403 0.84 F7 (0.61) CES1PPARGPPARDPPARAPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018022286-A1 ORAL DELIVERY DEVICE AND METHODS Zeteo Biomedical LLC (US) 2018-02-01 WO disclosed
WO-2017083870-A1 DEEP DRAW CONTAINER FORMING METHOD AND NURITIONAL PRODUCT CONTAINERS MYSTIC PHARMACEUTICALS, INC. (US) 2017-05-18 WO disclosed
EP-0628602-B2 Transparent polyamide compositions without heat deformation ARKEMA FRANCE (FR) 2006-08-09 EP disclosed
EP-0628602-B1 Transparent polyamide compositions without heat deformation ATOFINA (FR) 2001-10-31 EP disclosed
EP-0628602-A1 Transparent polyamide compositions without heat deformation ELF ATOCHEM S.A. (FR) 1994-12-14 EP disclosed
EP-0382547-A2 Thermoplastic resin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-08-16 EP disclosed