SCHEMBL16248238

SCHEMBL16248238

C=CC(=O)O[C@@]1(CC)CC1C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.36
HPGD P15428 1/20 0.36
ALDH1A1 P00352 4/20 0.35
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31
THRB P10828 2/20 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
SCHEMBL6053923 0.86 TSHR (0.38) TSHRHPGDALDH1A1THRB
SCHEMBL14519294 0.84 HPGD (0.31) TSHRHPGD
SCHEMBL13713861 0.82 TSHR (0.32) TSHRHPGDALDH1A1
SCHEMBL4128963 0.80 TSHR (0.33) TSHRHPGDALDH1A1
SCHEMBL29142933 0.79 TSHR (0.30) TSHRHPGDCYP3A4HSD17B10
Formic Acid SCHEMBL27677345 0.77
SCHEMBL4401644 0.76 HPGD (0.30) TSHRHPGD
SCHEMBL21694356 0.75 TSHR (0.32) TSHRHPGDALDH1A1THRB
SCHEMBL14535087 0.75 HPGD (0.32) TSHRHPGD
SCHEMBL4399280 0.75 HPGD (0.33) TSHRHPGD

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-20140342576-A1 ULTRAVIOLET-CURABLE RESIN MATERIAL FOR PATTERN TRANSFER AND MAGNETIC RECORDING MEDIUM MANUFACTURING METHOD USING THE SAME KABUSHIKI KAISHA TOSHIBA (JP) 2014-11-20 US disclosed