SCHEMBL5031033

SCHEMBL5031033

CCCO[Si](Cl)(OCCC)Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.40
KCNA3 P22001 1/20 0.35
KMT2A Q03164 3/20 0.35
CHRNB2 P17787 2/20 0.35
CHRNB4 P30926 2/20 0.35
CHRNA3 P32297 2/20 0.35
CHRNA7 P36544 2/20 0.35
CHRNA4 P43681 2/20 0.35
MEN1 O00255 2/20 0.35
LMNA P02545 1/20 0.35
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
MLNR O43193 1/20 0.33
NR1I2 O75469 1/20 0.33
ESR1 P03372 1/20 0.33
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
ADRB2 P07550 1/20 0.33
CHRM2 P08172 1/20 0.33
ADRB1 P08588 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
SCHEMBL5032217 0.89 LTA4H (0.50) LTA4HKCNA3LMNAMLNRNR1I2
SCHEMBL5027548 0.84 LTA4H (0.41) LTA4HKCNA3KMT2ACHRNB2CHRNB4
SCHEMBL1608841 0.80 LTA4H (0.42) LTA4HKCNA3KMT2ACHRNB2CHRNB4
SCHEMBL5034242 0.80 LTA4H (0.42) LTA4HKCNA3KMT2ACHRNB2CHRNB4
SCHEMBL1609266 0.80 LTA4H (0.42) LTA4HKCNA3KMT2ACHRNB2CHRNB4
SCHEMBL5029761 0.80 LTA4H (0.41) LTA4HKCNA3KMT2ACHRNB2CHRNB4
SCHEMBL18108331 0.77 LTA4H (0.38) LTA4HKCNA3CHRNB2CHRNB4CHRNA3
SCHEMBL1042227 0.76 LTA4H (0.45) LTA4HKCNA3KMT2AMEN1MAOA
SCHEMBL5029859 0.76 LMNA (0.40) KMT2AMEN1LMNAESR1ADRB2
SCHEMBL6356238 0.76 LTA4H (0.39) LTA4HKCNA3KMT2ACHRNB2CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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