SCHEMBL4236579

SCHEMBL4236579

C=CC(=O)OC(CC[SiH](OCCCC)OCCCC)OC(=O)C=C

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.47
HPGD P15428 1/20 0.47
THRB P10828 3/20 0.35
THRA P10827 1/20 0.35
ATM Q13315 1/20 0.35
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL4226054 0.91 TSHR (0.39) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL28019194 0.87 TSHR (0.46) TSHRHPGDTHRBTHRAATM
SCHEMBL4231973 0.84 TSHR (0.34) TSHRHPGDALDH1A1CYP3A4
SCHEMBL4231827 0.79 TSHR (0.41) TSHRHPGDTHRBALDH1A1
SCHEMBL15536424 0.79 TSHR (0.41) TSHRHPGDTHRBTHRAALDH1A1
SCHEMBL9578994 0.79 TSHR (0.54) TSHRHPGDTHRBTHRAATM
SCHEMBL9627161 0.79 TSHR (0.41) TSHRHPGDTHRBTHRAATM
SCHEMBL5698950 0.78 TSHR (0.68) TSHRHPGDTHRBTHRAATM
SCHEMBL4225957 0.78 TSHR (0.36) TSHRHPGDALDH1A1CYP3A4
SCHEMBL28001865 0.78 TSHR (0.38) TSHRHPGDALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090263631-A1 FILM FORMING COMPOSITION FOR NANOIMPRINTING AND METHOD FOR PATTERN FORMATION TOKYO OHKA KOGYO CO., LTD. (JP) 2009-10-22 US disclosed