SCHEMBL26333375

SCHEMBL26333375

C=C(C)C(=O)OCCCc1cc(-c2ccc(-c3ccc([C@H]4CC[C@H](CCCCC)CC4)cc3)cc2CC)cc(CCCOC(=O)C(=C)C)c1OCCC(CO)(CO)CCC

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 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
SCHEMBL18645450 1.00 TSHR (0.30) TSHR
SCHEMBL21232224 0.99 TSHR (0.31) TSHR
SCHEMBL21097848 0.98 FFAR4 (0.30)
SCHEMBL18645448 0.97 TSHR (0.30) TSHR
SCHEMBL21098132 0.97 TSHR (0.30) TSHR
SCHEMBL21098139 0.97 TSHR (0.30) TSHR
SCHEMBL21675435 0.97 TSHR (0.30) TSHR
SCHEMBL22665930 0.97 TSHR (0.31) TSHR
SCHEMBL21097894 0.96 TSHR (0.32) TSHR
SCHEMBL21232368 0.96 TSHR (0.31) 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
US-20230265344-A1 POLYMERISABLE LIQUID CRYSTAL MATERIAL AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2023-08-24 US disclosed