SCHEMBL8009053

SCHEMBL8009053

C=CC(=O)OC(=O)CC(=O)OC(=O)C=C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 10/20 0.42
ALDH1A1 P00352 9/20 0.42
TP53 P04637 3/20 0.42
HIF1A Q16665 3/20 0.42
CYP3A4 P08684 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPK1 P28482 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 2/20 0.33
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
FGFR4 P22455 1/20 0.32
THRB P10828 3/20 0.31
ALOX15 P16050 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
SCHEMBL28853930 0.89 MGAM (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
Ammonia Solution, Strong SCHEMBL28082585 0.89 MGAM (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL28082468 0.89 MGAM (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL28082963 0.89 MGAM (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL28190639 0.89 MGAM (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL6253087 0.87 HSD17B10 (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL867454 0.85 MGAM (0.48) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL301337 0.83 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL7167538 0.82 TSHR (0.34) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL3879634 0.82 HSD17B10 (0.52) TSHRALDH1A1TP53HIF1ACYP3A4

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-20230295456-A1 SURFACE-ERODING PHOTO-CURABLE ACRYLATED AND METHACRYLATED ANHYDRIDE BASED RESINS SOUTH DAKOTA BOARD OF REGENTS 2023-09-21 US disclosed
WO-2000020926-A9 IONIZATION RADIATION IMAGEABLE PHOTOPOLYMER COMPOSITIONS DU PONT (US) 2000-09-14 WO disclosed