SCHEMBL5014593

SCHEMBL5014593

CC(C)c1cc(C(C)C)c(OP(Oc2c(C(C)C)cc(C(C)C)cc2C(C)C)Oc2c(C(C)C)cc(C(C)C)cc2C(C)C)c(C(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.43
GABRB2 P47870 1/20 0.43
FABP4 P15090 3/20 0.42
FABP3 P05413 2/20 0.42
FABP5 Q01469 1/20 0.41
RARG P13631 2/20 0.33
RXRA P19793 2/20 0.33
PPARG P37231 2/20 0.33
SOAT2 O75908 1/20 0.31
MYC P01106 1/20 0.31
SOAT1 P35610 1/20 0.31
MAP2K3 P46734 1/20 0.31
ROCK2 O75116 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL7766607 0.88 GABRA1 (0.38) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL11438535 0.83 GABRA1 (0.45) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL14640958 0.76 GABRA1 (0.46) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL24413824 0.76 GABRA1 (0.46) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL14462076 0.75 LMNA (0.33) RXRA
SCHEMBL16908322 0.74 GABRA1 (0.45) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL3267228 0.74 GABRA1 (0.50) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL10212529 0.73 RXRA (0.46) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL11109627 0.73 GABRA1 (0.43) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL1239795 0.72 LMNA (0.36) GABRA1GABRB2FABP4FABP3FABP5

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
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-20060257706-A1 POLYMER ELECTROLYTE COMPOSITION AND FUEL CELL HIDAKA YASUAKI 2006-11-16 US 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
US-3960758-A SULFUR-CONTAINING PHENOL BAYER AKTIENGESELLSCHAFT (DT) 1976-06-01 US disclosed