SCHEMBL28049657

SCHEMBL28049657

C=CC(=O)OCCO[PH](=O)OC

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.53
ALDH1A1 P00352 4/20 0.53
TP53 P04637 3/20 0.53
HIF1A Q16665 3/20 0.53
HSD17B10 Q99714 1/20 0.53
HPGD P15428 1/20 0.48
CYP3A4 P08684 2/20 0.48
THRB P10828 3/20 0.45
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ATM Q13315 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
SCHEMBL28298797 0.89 TSHR (0.55) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL976376 0.88 TSHR (0.61) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL14070720 0.80 TSHR (0.46) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL976374 0.79 TSHR (0.59) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL2306357 0.77 TSHR (0.63) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL93462 0.77 TSHR (0.84) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL30604742 0.77 TSHR (0.84) TSHRALDH1A1TP53HIF1AHSD17B10
Butane SCHEMBL17350594 0.76 TSHR (0.56) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL38483 0.76
Propene SCHEMBL11227474 0.75 TSHR (0.73) TSHRALDH1A1TP53HIF1AHSD17B10

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
CN-103502888-B Negative light-sensitive resin combination, cured film, partition wall and black matrix\" and manufacture method thereof, colour filter and organic EL ASAHI GLASS CO.,LTD. (JP) 2016-05-25 CN disclosed