SCHEMBL5718756

SCHEMBL5718756

CC(C)(C)COC(=O)CCCCC(=O)O.CCCCCC(O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.51
FFAR1 O14842 2/20 0.51
PAM P19021 2/20 0.47
AKR1B1 P15121 1/20 0.46
MAPT P10636 1/20 0.45
GPR84 Q9NQS5 7/20 0.44
PPARG P37231 7/20 0.44
PPARD Q03181 7/20 0.44
PPARA Q07869 7/20 0.44
HDAC11 Q96DB2 5/20 0.44
TSHR P16473 4/20 0.44
PTPN1 P18031 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TLR2 O60603 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
FABP4 P15090 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
MEN1 O00255 1/20 0.44
ESR1 P03372 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
SCHEMBL28388701 0.91 PAM (0.42) FFAR4FFAR1PAMAKR1B1MAPT
Hexane SCHEMBL844454 0.89 PAM (0.58) FFAR4FFAR1PAMAKR1B1MAPT
Dodecanoate SCHEMBL11234787 0.88 PAM (0.61) FFAR4FFAR1PAMAKR1B1MAPT
Heptanoate SCHEMBL5357269 0.88 PAM (0.61) FFAR4FFAR1PAMAKR1B1MAPT
Octanoic Acid SCHEMBL8356248 0.88 PAM (0.61) FFAR4FFAR1PAMAKR1B1MAPT
SCHEMBL736748 0.88 FFAR4 (0.48) FFAR4FFAR1PAMAKR1B1MAPT
SCHEMBL10796228 0.85 FFAR4 (0.57) FFAR4FFAR1PAMAKR1B1MAPT
SCHEMBL245738 0.83 DGKA (0.61) PAMMAPTTSHRALDH1A1TDP1
SCHEMBL852014 0.83 TSHR (0.48) FFAR4FFAR1PAMAKR1B1GPR84
SCHEMBL24562851 0.82 DGKA (0.53) PAMMAPTTSHRALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111072914-A High-solid-content polyurethane resin, impregnating slurry and application thereof 上海华峰新材料研发科技有限公司 2020-04-28 CN claimed
EP-1301564-B1 PERSONAL CARE COMPOSITION COMPRISING A PLASTICIZED WATERBORNE POLYURETHANE DISPERSION NOVEON IP HOLDINGS CORP (US) 2006-05-10 EP claimed
US-6576702-B2 Prepared by reacting a polyisocyanate and an active hydrogen compounds, dispersing the prepolymer in water, and chain extending the prepolymer by reaction with at least one of water, inorganic or organic polyamine, adding a plasticizer NOVEON IP HOLDINGS CORP. 2003-06-10 US claimed
EP-1301564-A1 PLASTICIZED WATERBORNE POLYURETHANE DISPERSIONS AND MANUFACTURING PROCESS Noveon IP Holdings Corp. (US) 2003-04-16 EP claimed
US-20020028875-A1 Plasticized waterborne polyurethane dispersions and manufacturing process NOVEON, INC. 2002-03-07 US claimed
WO-2002008327-A1 PLASTICIZED WATERBORNE POLYURETHANE DISPERSIONS AND MANUFACTURING PROCESS NOVEON IP HOLDINGS CORP. (US) 2002-01-31 WO claimed
US-10640702-B2 Coated particles and methods for their manufacture and use COVESTRO LLC (US) 2020-05-05 US disclosed
CN-111072914-A High-solid-content polyurethane resin, impregnating slurry and application thereof 上海华峰新材料研发科技有限公司 2020-04-28 CN disclosed
US-20150034314-A1 COATED PARTICLES AND METHODS FOR THEIR MANUFACTURE AND USE COVESTRO LLC 2015-02-05 US disclosed