SCHEMBL25639231

SCHEMBL25639231

C=C(C)C(=O)OCCCc1cc(-c2ccc(-c3ccc(-c4ccc(C5CCC(CCCCC)CC5)cc4)cc3)cc2CC)cc(CCCOC(=O)C(=C)C)c1CCC(C)(CO)CO

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
FFAR4 Q5NUL3 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
SCHEMBL18646444 0.91 FFAR4 (0.32) TSHRFFAR4
SCHEMBL21231958 0.91 FFAR4 (0.32) TSHRFFAR4
SCHEMBL18646387 0.89 FFAR4 (0.31) TSHRFFAR4
SCHEMBL21232220 0.89 FFAR4 (0.32) TSHRFFAR4
SCHEMBL21115971 0.89 FFAR4 (0.32) TSHRFFAR4
SCHEMBL21232298 0.88 FFAR4 (0.32) TSHRFFAR4
SCHEMBL21615468 0.88 TSHR (0.31) TSHR
SCHEMBL22592371 0.88 FFAR4 (0.31) TSHRFFAR4
SCHEMBL21115828 0.88 FFAR4 (0.31) FFAR4
SCHEMBL21232041 0.87 FFAR4 (0.32) FFAR4

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-2023110962-A1 LIQUID-CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2023-06-22 WO disclosed