SCHEMBL20144563

SCHEMBL20144563

C=CC(=O)OCCC(=O)OCCC

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.60
HPGD P15428 1/20 0.60
ALDH1A1 P00352 5/20 0.50
TP53 P04637 3/20 0.50
HIF1A Q16665 3/20 0.50
CYP3A4 P08684 2/20 0.50
HSD17B10 Q99714 1/20 0.50
THRB P10828 2/20 0.46
HCAR2 Q8TDS4 2/20 0.46
DGKA P23743 1/20 0.42
ATM Q13315 1/20 0.39
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ADRA2A P08913 1/20 0.36
ADRA1A P35348 1/20 0.36
DNM1 Q05193 1/20 0.36
MAPT P10636 1/20 0.35
BLM P54132 1/20 0.35

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
SCHEMBL1673486 0.89 TSHR (0.79) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2459290 0.88 TSHR (0.64) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL9143157 0.88 TSHR (0.64) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL30074662 0.88 TSHR (0.75) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL14982 0.88
SCHEMBL5829420 0.86 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2610334 0.86 TSHR (0.62) TSHRHPGDALDH1A1TP53HIF1A
Propene SCHEMBL4273406 0.86 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL9443501 0.86 TSHR (0.68) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1035378 0.86

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
EP-2102708-B1 CURABLE COMPOSITION, COLOR FILTER, AND MANUFACTURING METHOD OF THE SAME FUJIFILM CORP (JP) 2018-05-16 EP disclosed