SCHEMBL4337716

SCHEMBL4337716

CCC=CCCCCCCCCCC=CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(O[SiH](c1ccccc1)c1ccccc1)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.35
FAAH O00519 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
ALDH1A1 P00352 4/20 0.33
F7 P08709 2/20 0.33
F3 P13726 2/20 0.33
MAPT P10636 2/20 0.33
CYP19A1 P11511 2/20 0.33
CYP3A4 P08684 2/20 0.33
ALOX15 P16050 2/20 0.33
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
OXER1 Q8TDS5 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
FFAR1 O14842 1/20 0.33
NR1I2 O75469 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
SCHEMBL4341910 1.00 EPHX2 (0.35) EPHX2FAAHCNR1CNR2ALDH1A1
SCHEMBL4333096 1.00 EPHX2 (0.35) EPHX2FAAHCNR1CNR2ALDH1A1
SCHEMBL4344025 0.95 EPHX2 (0.35) EPHX2FAAHCNR1CNR2ALDH1A1
SCHEMBL4335115 0.92 SOAT2 (0.35) EPHX2FAAHCNR1CNR2MAPT
SCHEMBL4341943 0.92 SOAT2 (0.38) EPHX2FAAHCNR1CNR2PPARG
SCHEMBL4341891 0.90 EPHX2 (0.39) EPHX2FAAHCNR1CNR2ALDH1A1
SCHEMBL15643948 0.80 PTGS2 (0.30) PTGS2
SCHEMBL702655 0.77 PRSS1 (0.33)
SCHEMBL706845 0.77 KCNH2 (0.33) ALDH1A1CYP3A4MEN1LMNAKMT2A
SCHEMBL2481870 0.76 CYSLTR2 (0.32) ALDH1A1MAPTCYP3A4ALOX15MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009133686-A1 MEDICAMENTS FOR TREATING ALZHEIMER'S DISEASE 有限会社アンティアンティ (JP) 2009-11-05 WO disclosed