SCHEMBL6589751

SCHEMBL6589751

CC(C)(C)[Si](C)(C)OCC1CC(O)CCN1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.41
MAPT P10636 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
FAAH O00519 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SPHK2 Q9NRA0 2/20 0.35
SPHK1 Q9NYA1 2/20 0.35

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
SCHEMBL7271114 0.82 FAAH (0.47) FAAHSPHK2SPHK1
SCHEMBL27511890 0.81 CNR2 (0.35) GBA1SIGMAR1FAAH
SCHEMBL6402255 0.80 MAPT (0.38) MAPTSIGMAR1
SCHEMBL1875799 0.79 LTA4H (0.38) SIGMAR1FAAHALDH1A1
SCHEMBL1005038 0.79 LTA4H (0.38) SIGMAR1FAAHALDH1A1
SCHEMBL1005039 0.79 LTA4H (0.38) SIGMAR1FAAHALDH1A1
SCHEMBL3955729 0.79 SIGMAR1 (0.53) SIGMAR1ALDH1A1
SCHEMBL29302010 0.77 CHRM2 (0.40) MAPTSIGMAR1
SCHEMBL6585773 0.77 MAPK1 (0.55) MAPTRAB9ASIGMAR1FAAHALDH1A1
SCHEMBL1872881 0.76 GBA1 (0.56) GBA1MAPTNPC1RAB9ASIGMAR1

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-0990653-B1 2-OXOIMIDAZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-09-15 EP disclosed
US-6258825-B1 ANALGESIC, A RELIEVER AGAINST TOLERANCE TO A NARCOTIC ANALGESIC REPRESENTED BY MORPHINE, REMEDY FOR PARKINSONISM, A REMEDY FOR CHOREA, AN ANTIDEPRESSANT, A REMEDY FOR DIABETES INSIPIDUS, A REMEDY FOR POLYURIA, OR HYPOTENSION BANYU PHARMACEUTICAL CO., LTD. (JP) 2001-07-10 US disclosed
CN-1258294-A 2-oxoimidazole derivs. BANYU PHARMA CO LTD (JP) 2000-06-28 CN disclosed
EP-0990653-A1 2-OXOIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 EP disclosed