SCHEMBL5712957

SCHEMBL5712957

CC(C=O)CCCCCCCCC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTK1 Q9Y2Q3 2/20 0.52
TSHR P16473 5/20 0.50
FFAR4 Q5NUL3 2/20 0.50
FFAR1 O14842 2/20 0.50
LMNA P02545 1/20 0.50
NFKB1 P19838 1/20 0.50
PMP22 Q01453 1/20 0.50
ALDH1A1 P00352 3/20 0.48
GPR84 Q9NQS5 6/20 0.46
PPARG P37231 6/20 0.46
PPARD Q03181 6/20 0.46
PPARA Q07869 6/20 0.46
HDAC11 Q96DB2 5/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46
PTPN1 P18031 2/20 0.46
SLC22A6 Q4U2R8 1/20 0.46
SLC22A8 Q8TCC7 1/20 0.46
MEN1 O00255 1/20 0.46

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
SCHEMBL17062999 1.00 GSTK1 (0.52) GSTK1TSHRFFAR4FFAR1LMNA
SCHEMBL17062972 1.00 GSTK1 (0.52) GSTK1TSHRFFAR4FFAR1LMNA
SCHEMBL27612561 0.98 GSTK1 (0.50) GSTK1TSHRFFAR4FFAR1LMNA
SCHEMBL18346531 0.91 GSTK1 (0.47) GSTK1TSHRFFAR4FFAR1LMNA
SCHEMBL5076974 0.91 GSTK1 (0.47) GSTK1TSHRFFAR4FFAR1LMNA
SCHEMBL173083 0.82
SCHEMBL13176643 0.82
SCHEMBL10521955 0.82 ADH1B (0.39) TSHRLMNA
SCHEMBL27554254 0.82 ABCC4 (0.50) GSTK1TSHRFFAR4FFAR1LMNA
SCHEMBL18763985 0.80 FFAR4 (0.67) TSHRFFAR4FFAR1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1360002-B1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEM PLASTIC (US) 2006-12-20 EP disclosed
EP-1360002-A2 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2003-11-12 EP disclosed
US-6307108-B1 SEPARATING ORGANOPHOSPHORUS LIGAND DEGRADATION PRODUCTS, REACTION BYPRODUCTS AND FORMYLESTER PRODUCTS FROM A REACTION PRODUCT FLUID COMPRISING ONE OR MORE UNREACTED UNSATURATED ESTER REACTANTS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2001-10-23 US disclosed
US-6303830-B1 SEPARATING ORGANOPHOSPHORUS LIGAND DEGRADATION PRODUCTS, REACTION BYPRODUCTS AND FORMYLESTER PRODUCTS FROM A REACTION PRODUCT FLUID COMPRISING UNREACTED UNSATURATED ESTER REACTANTS, AND A METAL-ORGANOPHOSPHORUS LIGAND COMPLEX UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2001-10-16 US disclosed
WO-2001068252-A2 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2001-09-20 WO disclosed
EP-0804399-B1 METHOD FOR OLEFIN HYDROFORMYLATION IN A BIPHASIC MEDIUM CENTRE NAT RECH SCIENT (FR) 2000-12-27 EP disclosed
US-5847228-A Process for the hydroformylation of an olefin in a two-phase medium CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1998-12-08 US disclosed