SCHEMBL8621998

SCHEMBL8621998

C=CC(=O)OCCOCCOCCO.CCCCOCCCC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.68
HPGD P15428 1/20 0.68
ALDH1A1 P00352 4/20 0.63
TP53 P04637 2/20 0.63
HIF1A Q16665 2/20 0.63
HSD17B10 Q99714 1/20 0.63
THRB P10828 5/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
HTT P42858 1/20 0.52
MAPT P10636 1/20 0.52
CYP3A4 P08684 2/20 0.48
ATM Q13315 1/20 0.47
HCAR2 Q8TDS4 1/20 0.42
EPHX2 P34913 1/20 0.41
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP1 P29466 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL9578389 1.00 TSHR (0.68) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL14655594 0.97 TSHR (0.68) TSHRHPGDALDH1A1TP53HIF1A
Triethylene Glycol SCHEMBL11033119 0.95 TSHR (0.76) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL8418850 0.94 THRB (0.62) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL8419313 0.93 TSHR (0.72) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL13111368 0.93 TSHR (0.78) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL152788 0.93 TSHR (0.78) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11430967 0.93 TSHR (0.78) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11443073 0.93 TSHR (0.78) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL244622 0.93 TSHR (0.78) TSHRHPGDALDH1A1TP53HIF1A

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-5843622-A Liquid photosensitive resin composition for use in forming a relief structure ASHAI KASEI KOGYO KABUSHIKI KAISHA (JP) 1998-12-01 US disclosed