SCHEMBL3769282

SCHEMBL3769282

C=C(CCOC)C(=O)OC(=O)C(=C)CCOCCCC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 2/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CES2 O00748 1/20 0.33
MAPT P10636 3/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ATM Q13315 1/20 0.32
MEN1 O00255 1/20 0.32
THRB P10828 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
RARB P10826 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
SCHEMBL3769280 0.85 TSHR (0.39) TSHRCYP3A4HPGDALDH1A1SMN1; SMN2
SCHEMBL27503739 0.84 TSHR (0.42) TSHRCYP3A4HPGDALDH1A1CES2
Acetic Acid SCHEMBL27512401 0.80 TSHR (0.39) TSHRCYP3A4HPGDALDH1A1SMN1; SMN2
SCHEMBL5310908 0.79 THRB (0.46) TSHRCYP3A4HPGDALDH1A1CES2
SCHEMBL125750 0.77 TSHR (0.45) TSHRCYP3A4HPGDALDH1A1CES2
SCHEMBL28158478 0.76 TSHR (0.40) TSHRALDH1A1SMN1; SMN2CES2MAPT
SCHEMBL6916133 0.76 CES1 (0.46) TSHRALDH1A1CES2HSD17B10MEN1
SCHEMBL5292928 0.75 TSHR (0.43) TSHRCYP3A4HPGDALDH1A1CES2
SCHEMBL28833990 0.75 TSHR (0.43) TSHRCYP3A4HPGDALDH1A1CES2
SCHEMBL9534599 0.74 CES2 (0.48) TSHRALDH1A1CES2HSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7847888-B2 Liquid crystal display device including protective films having predetermined moisture permeability characteristics FUJIFILM CORPORATION (JP) 2010-12-07 US disclosed
US-20080218666-A1 Liquid crystal display device FUJIFILM CORPORATION (JP) 2008-09-11 US disclosed