SCHEMBL22083068

SCHEMBL22083068

C=C(C)C(=O)OCC(CCC1CCC(C2CCC(CCCCC)CC2)CC1)(COC(=O)C(=C)C)COC(=O)C(=C)CC(CO)CO

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL21398723 0.96 TSHR (0.33) TSHR
SCHEMBL20882829 0.96 TSHR (0.33) TSHR
SCHEMBL20882550 0.91 TSHR (0.34) TSHR
SCHEMBL22083070 0.88 TSHR (0.43) TSHR
SCHEMBL21398237 0.87 TSHR (0.34) TSHR
SCHEMBL21398234 0.87 TSHR (0.34) TSHR
SCHEMBL20882655 0.86 TSHR (0.36) TSHR
SCHEMBL20882548 0.85 TSHR (0.35) TSHR
SCHEMBL20882482 0.85 TSHR (0.36) TSHR
SCHEMBL20882794 0.85 TSHR (0.36) TSHR

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
WO-2020116380-A1 COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC株式会社 2020-06-11 WO disclosed