SCHEMBL5014608

SCHEMBL5014608

CC1(OC(=O)CCSCCC(=O)O)CCCC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
CYP19A1 P11511 1/20 0.40
TSHR P16473 2/20 0.34
PLA2G4B P0C869 1/20 0.33
CYP2C19 P33261 1/20 0.32
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
PHF8 Q9UPP1 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
BHMT Q93088 1/20 0.31
ALDH1A1 P00352 3/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPT P10636 1/20 0.31
CYP26A1 O43174 1/20 0.30
CYP26B1 Q9NR63 1/20 0.30

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
SCHEMBL5012980 0.98 LMNA (0.45) LMNAKMT2AHSD17B10TDP1CYP19A1
SCHEMBL5014607 0.93 CYP19A1 (0.44) LMNAKMT2AHSD17B10TDP1CYP19A1
SCHEMBL5012977 0.91 CYP19A1 (0.46) LMNAKMT2AHSD17B10TDP1CYP19A1
SCHEMBL25397837 0.82 CYP19A1 (0.47) LMNACYP19A1TSHRCYP2C19KDM6B
SCHEMBL5012963 0.81 LMNA (0.38) LMNAKMT2AHSD17B10TDP1
SCHEMBL28942497 0.81 TSHR (0.44) LMNAKMT2AHSD17B10TDP1CYP19A1
SCHEMBL28408857 0.79 CYP19A1 (0.45) LMNAKMT2AHSD17B10TDP1CYP19A1
SCHEMBL13588108 0.79 CYP19A1 (0.45) CYP19A1
SCHEMBL31497999 0.78 CYP19A1 (0.37) CYP19A1
SCHEMBL25397835 0.78 CYP19A1 (0.53) LMNACYP19A1TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1947725-A2 Polymer electrolyte composition and fuel cell Sumitomo Chemical Company, Limited (JP) 2008-07-23 EP disclosed
EP-1289041-B1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL CO (JP) 2008-03-12 EP disclosed
US-20030113605-A1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-06-19 US disclosed
EP-1289041-A2 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-05 EP disclosed