SCHEMBL8965775

SCHEMBL8965775

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

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ALDH1A1 P00352 2/20 0.34

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
SCHEMBL19810576 0.86 TSHR (0.36) TSHRALDH1A1
SCHEMBL28369426 0.85 ALDH1A1 (0.37) TSHRALDH1A1
SCHEMBL8967389 0.85 TSHR (0.43) TSHRALDH1A1
SCHEMBL8965801 0.85 TSHR (0.43) TSHRALDH1A1
SCHEMBL6746515 0.81 TSHR (0.38) TSHRALDH1A1
SCHEMBL27285648 0.81 TSHR (0.35) TSHRALDH1A1
SCHEMBL713871 0.79 TSHR (0.39) TSHRALDH1A1
SCHEMBL6422504 0.79 TSHR (0.36) TSHRALDH1A1
Ethylene SCHEMBL4150916 0.78 TSHR (0.38) TSHRALDH1A1
SCHEMBL28035425 0.77 TSHR (0.51) TSHRALDH1A1

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