SCHEMBL8966142

SCHEMBL8966142

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

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
ALDH1A1 P00352 2/20 0.46
THRB P10828 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
HSD17B10 Q99714 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
SCHEMBL22231332 0.91 TSHR (0.43) TSHRALDH1A1THRBTDP1
SCHEMBL5177443 0.90 TSHR (0.50) TSHRALDH1A1THRBTDP1HSD17B10
SCHEMBL4734217 0.90 TSHR (0.50) TSHRALDH1A1THRBTDP1HSD17B10
SCHEMBL9070457 0.89 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL8966022 0.87 TSHR (0.41) TSHRALDH1A1THRB
SCHEMBL11053273 0.85 TSHR (0.46) TSHRALDH1A1THRBTDP1HSD17B10
SCHEMBL29025168 0.84 TSHR (0.36) TSHRALDH1A1
SCHEMBL23493903 0.83 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL5179633 0.83 TSHR (0.45) TSHRALDH1A1THRBTDP1
SCHEMBL22231005 0.83 TSHR (0.45) TSHRALDH1A1THRBTDP1

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-5547762-A THERMOSETTING RESIN LAYER BRIDGESTONE CORPORATION (JP) 1996-08-20 US disclosed