SCHEMBL5050256

SCHEMBL5050256

CC(C)c1ccc(Cc2ccc(C(C)C)cc2C(C)C)c(C(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 2/20 0.41
FABP4 P15090 2/20 0.41
FABP5 Q01469 1/20 0.41
LMNA P02545 1/20 0.40
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
TRPA1 O75762 1/20 0.39
PTGS1 P23219 1/20 0.39
CACNA1C Q13936 1/20 0.39
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
ALOX12 P18054 1/20 0.38
HTT P42858 1/20 0.38
HIF1A Q16665 1/20 0.38
RNASEH1 O60930 1/20 0.35
HTR1D P28221 2/20 0.35
TYR P14679 2/20 0.34
IDO1 P14902 2/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL28119935 0.85 GABRA1 (0.46) FABP3FABP4FABP5LMNAGABRA1
SCHEMBL28043208 0.84 HSPA5 (0.52) LMNAGABRA1GABRB2TRPA1PTGS1
SCHEMBL27628517 0.84 GPR55 (0.33) FABP3FABP4FABP5LMNAGABRA1
SCHEMBL21145862 0.83 FABP3 (0.38) FABP3FABP4FABP5LMNAGABRA1
SCHEMBL677272 0.83 FABP3 (0.38) FABP3FABP4FABP5LMNAGABRA1
SCHEMBL22356520 0.83 FABP3 (0.38) FABP3FABP4FABP5LMNAGABRA1
SCHEMBL9686320 0.83 ACE2 (0.42) FABP3FABP4FABP5LMNAGABRA1
SCHEMBL8638358 0.82 LMNA (0.40) FABP3FABP4FABP5LMNAGABRA1
SCHEMBL27648531 0.82 FABP3 (0.33) FABP3FABP4FABP5LMNAGABRA1
SCHEMBL28043207 0.82 ESR1 (0.44) GABRA1GABRB2TRPA1PTGS1CACNA1C

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
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