SCHEMBL2798093

SCHEMBL2798093

CCO[Si](CCCOc1ccc(C(=O)c2ccc(OCCC[Si](OCC)(OCC)OCC)cc2)cc1)(OCC)OCC

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
L3MBTL1 Q9Y468 4/20 0.50
LMNA P02545 2/20 0.50
MAPK1 P28482 1/20 0.50
PPARA Q07869 2/20 0.48
GAA P10253 2/20 0.47
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
POLB P06746 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 1/20 0.45
PLA2G4B P0C869 1/20 0.45
MAPT P10636 1/20 0.44
HRH2 P25021 1/20 0.44
HRH1 P35367 1/20 0.44

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
SCHEMBL2796850 0.94 L3MBTL1 (0.59) KMT2ANPSR1L3MBTL1LMNAMAPK1
SCHEMBL17457100 0.86 SRD5A2 (0.51) KMT2APOLBNPC1RAB9AMAPT
SCHEMBL17457099 0.86 SRD5A2 (0.51) KMT2APOLBNPC1RAB9AMAPT
SCHEMBL17457111 0.84 CA12 (0.49) HRH2HRH1
SCHEMBL17457110 0.84 CA12 (0.49) HRH2HRH1
SCHEMBL17457113 0.84 ABCG2 (0.47) MAPT
SCHEMBL17457112 0.84 ABCG2 (0.47) MAPT
SCHEMBL8673385 0.84 POLB (0.44) L3MBTL1LMNAPPARAGAATP53
SCHEMBL2798810 0.84 MAPT (0.54) KMT2ANPSR1L3MBTL1LMNAMAPK1
SCHEMBL17457036 0.82 SRD5A2 (0.49) KMT2APOLBNPC1RAB9AMAPT

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
US-20060030677-A1 Prepared by polymerizing conjugated monomer with a lanthanide-based catalyst to form a pseudo-living polymer and reacting the polymer with a di- or trihydrocarbyloxysilane having a reactive functional group such as (meth)acrylate, epoxy, or isocyanate that forms a chemical bond with the polymer; curable ENEOS MATERIALS CORPORATION (JP) 2006-02-09 US claimed
US-6992147-B1 Modified polymers prepared with lanthanide-based catalysts BRIDGESTONE CORPORATION (JP) 2006-01-31 US claimed
US-7750087-B2 Modified polymers prepared with lanthanide-based catalysts BRIDGESTONE CORPORATION (JP) 2010-07-06 US disclosed
US-20060030677-A1 Prepared by polymerizing conjugated monomer with a lanthanide-based catalyst to form a pseudo-living polymer and reacting the polymer with a di- or trihydrocarbyloxysilane having a reactive functional group such as (meth)acrylate, epoxy, or isocyanate that forms a chemical bond with the polymer; curable ENEOS MATERIALS CORPORATION (JP) 2006-02-09 US disclosed
US-6992147-B1 Modified polymers prepared with lanthanide-based catalysts BRIDGESTONE CORPORATION (JP) 2006-01-31 US disclosed