SCHEMBL8145263

SCHEMBL8145263

CCC/C=C(\O)C(=O)OCCOCCOC(=O)/C(O)=C/CCC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.40
TSHR P16473 5/20 0.36
ALDH1A1 P00352 3/20 0.36
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 1/20 0.36
HCAR2 Q8TDS4 4/20 0.33
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
ATM Q13315 1/20 0.31
EPHX2 P34913 1/20 0.31
DGKA P23743 1/20 0.31
RAD52 P43351 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL12080812 0.88 HCAR2 (0.44) TSHRALDH1A1HCAR2GRIK1GRIK2
SCHEMBL11375198 0.82 NPSR1 (0.42) TSHRALDH1A1HSD17B10HCAR2GRIK1
SCHEMBL19253779 0.77 GRIK1 (0.37) ALDH1A1HCAR2GRIK1GRIK2
SCHEMBL4762026 0.77 HCAR2 (0.41) TSHRALDH1A1HCAR2GRIK1ATM
SCHEMBL27629984 0.77 ATM (0.48) TSHRALDH1A1HCAR2GRIK1ATM
SCHEMBL3019504 0.77 HCAR2 (0.41) TSHRALDH1A1HCAR2GRIK1ATM
SCHEMBL7797964 0.75 GRIK1 (0.36) ALDH1A1GRIK1GRIK2
SCHEMBL27568373 0.75 GRIK1 (0.36) TSHRALDH1A1GRIK1GRIK2
Acrylic Acid SCHEMBL28230336 0.75 TSHR (0.41) TSHRALDH1A1HCAR2GRIK1GRIK2
SCHEMBL27550859 0.74 TSHR (0.53) TSHRHCAR2EPHX2RAD52NPSR1

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-6164785-A Antiglaring film DAI NIPPON PRINTING CO., LTD. (JP) 2000-12-26 US disclosed