SCHEMBL6896537

SCHEMBL6896537

CC=COC(C)Cc1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL22721242 0.83 HMGCR (0.32) HMGCR
SCHEMBL3651085 0.82 FFAR4 (0.35) HMGCRNPC1RAB9A
SCHEMBL169917 0.80 HMGCR (0.32) HMGCRNPC1RAB9A
SCHEMBL29807700 0.79 HSPA5 (0.43) NPC1RAB9A
SCHEMBL9340775 0.79 HSPA5 (0.43) NPC1RAB9A
SCHEMBL19884685 0.78 NPC1 (0.38) NPC1RAB9A
SCHEMBL6837010 0.78 NPC1 (0.38) NPC1RAB9A
SCHEMBL27467453 0.78 NPC1 (0.38) NPC1RAB9A
SCHEMBL6832896 0.78 ALDH1A1 (0.34)
SCHEMBL8069924 0.78 NPC1 (0.36) NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3579737-B2 2004-10-20 JP claimed
EP-0593684-B1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPHTHALMICS INC (US) 1997-07-16 EP claimed
EP-0736062-A4 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPTHALMICS INC (US) 1997-04-16 EP claimed
EP-0736062-A1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPTHALMICS, INC. (US) 1996-10-09 EP claimed
US-5444106-A High refractive index silicone compositions KABI PHARMACIA OPHTHALMICS, INC. (US) 1995-08-22 US claimed
WO-1995017460-A1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPHTHALMICS, INC. (US) 1995-06-29 WO claimed
EP-0593684-A4 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPTHALMICS INC (US) 1994-07-13 EP claimed
EP-0593684-A1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS. KABI PHARMACIA OPTHALMICS INC (US) 1994-04-27 EP claimed
WO-1993021245-A1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPHTHALMICS, INC. (US) 1993-10-28 WO claimed
EP-0889916-B1 HIGH REFRACTIVE INDEX HYDROGELS PREPARED FROM POLYMERS AND COPOLYMERS OF N-BENZYL-N-METHYLACRYLAMIDE UPJOHN CO (US) 2003-05-07 EP disclosed
EP-0593684-B1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPHTHALMICS INC (US) 1997-07-16 EP disclosed
EP-0736062-A4 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPTHALMICS INC (US) 1997-04-16 EP disclosed
EP-0736062-A1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPTHALMICS, INC. (US) 1996-10-09 EP disclosed
US-5444106-A High refractive index silicone compositions KABI PHARMACIA OPHTHALMICS, INC. (US) 1995-08-22 US disclosed
WO-1995017460-A1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPHTHALMICS, INC. (US) 1995-06-29 WO disclosed
EP-0593684-A4 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPTHALMICS INC (US) 1994-07-13 EP disclosed
EP-0593684-A1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS. KABI PHARMACIA OPTHALMICS INC (US) 1994-04-27 EP disclosed
WO-1993021245-A1 HIGH REFRACTIVE INDEX SILICONE COMPOSITIONS KABI PHARMACIA OPHTHALMICS, INC. (US) 1993-10-28 WO disclosed