SCHEMBL5031012

SCHEMBL5031012

CCCCO[Si](OCCCC)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.53
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP19A1 P11511 1/20 0.41
KCNA3 P22001 1/20 0.40
MLNR O43193 1/20 0.40
NR1I2 O75469 1/20 0.40
ESR1 P03372 1/20 0.40
NR3C1 P04150 1/20 0.40
PGR P06401 1/20 0.40
ADRB2 P07550 1/20 0.40
CHRM2 P08172 1/20 0.40
ADRB1 P08588 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
CHRM1 P11229 1/20 0.40
DRD2 P14416 1/20 0.40

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
SCHEMBL5034225 0.96 LTA4H (0.53) LTA4HCYP1A2CYP2C9CYP2C19CYP2D6
SCHEMBL1609518 0.96 LTA4H (0.53) LTA4HCYP1A2CYP2C9CYP2C19CYP2D6
SCHEMBL11364618 0.93 LTA4H (0.51) LTA4HKCNA3MLNRNR1I2ESR1
SCHEMBL4804057 0.91 LTA4H (0.53) LTA4HKCNA3MLNRNR1I2ESR1
SCHEMBL1608841 0.88 LTA4H (0.42) LTA4HKCNA3MLNRNR1I2ESR1
SCHEMBL19809310 0.87 LTA4H (0.50) LTA4HKCNA3MLNRNR1I2ESR1
SCHEMBL19809316 0.86 LTA4H (0.49) LTA4HKCNA3MLNRNR1I2ESR1
SCHEMBL19809286 0.86 LTA4H (0.49) LTA4HKCNA3MLNRNR1I2ESR1
SCHEMBL1609266 0.84 LTA4H (0.42) LTA4HKCNA3MLNRNR1I2ESR1
SCHEMBL5034242 0.84 LTA4H (0.42) LTA4HKCNA3MLNRNR1I2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106661273-B Surface-modified composite silica particles and polyimide film comprising same 可隆工业株式会社 2020-05-12 CN claimed
CN-106661273-B Surface-modified composite silica particles and polyimide film comprising same 可隆工业株式会社 2020-05-12 CN disclosed
EP-1999167-A2 ZIEGLER-NATTA CATALYST WITH IN SITU-GENERATED DONOR Novolen Technology Holdings, C.V. (NL) 2008-12-10 EP disclosed
WO-2007106348-A2 ZIEGLER-NATTA CATALYST WITH IN SITU-GENERATED DONOR NOVOLEN TECHNOLOGY HOLDINGS C.V. (NL) 2007-09-20 WO disclosed
US-20070213204-A1 Ziegler-Natta catalyst with in situ-generated donor NOVOLEN TECHNOLOGY HOLDINGS C.V. 2007-09-13 US disclosed