SCHEMBL6647409

SCHEMBL6647409

CCC(CCO[Si](C)(C)C)(c1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.38
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32
GABRP O00591 1/20 0.30
GABRD O14764 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB1 P18505 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 1/20 0.30
GABRA2 P47869 1/20 0.30
GABRB2 P47870 1/20 0.30
GABRA4 P48169 1/20 0.30
GABRE P78334 1/20 0.30
GABRA6 Q16445 1/20 0.30
GABRG1 Q8N1C3 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
SCHEMBL6654029 0.94 PNMT (0.40) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL6650610 0.89 PNMT (0.37) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL6650823 0.88 PNMT (0.32) PNMT
SCHEMBL6651748 0.87 PNMT (0.35) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL6649917 0.84 PNMT (0.38) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL6650368 0.83 PNMT (0.36) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL6651619 0.81 PNMT (0.32) PNMT
SCHEMBL6652340 0.80 PNMT (0.38) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL6653356 0.79 PNMT (0.38) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL6651172 0.78 PNMT (0.31) PNMT

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
US-6534665-B1 Used for polymerization and copolymerization of olefins REPSOL QUIMICA S.A. (ES) 2003-03-18 US claimed
EP-1095944-B1 Single-carbon bridged bis cyclopentadienyl compounds and metallocene complexes thereof REPSOL QUIMICA SA (ES) 2004-03-17 EP disclosed
US-6534665-B1 Used for polymerization and copolymerization of olefins REPSOL QUIMICA S.A. (ES) 2003-03-18 US disclosed
EP-1095944-A1 Single-carbon bridged bis cyclopentadienyl compounds and metallocene complexes thereof REPSOL QUIMICA S.A. (ES) 2001-05-02 EP disclosed