SCHEMBL29953213

SCHEMBL29953213

CC(=O)[C@@H]1CC=CC[C@]1(C)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CD81 P60033 1/20 0.31
CYP3A4 P08684 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
SCHEMBL10740811 0.86 MEN1 (0.36)
SCHEMBL1989180 0.86 MEN1 (0.36)
SCHEMBL1926380 0.86 MEN1 (0.36)
SCHEMBL1285662 0.86 MEN1 (0.36)
SCHEMBL29842587 0.76 FFAR3 (0.31)
SCHEMBL7025871 0.70
SCHEMBL9543690 0.70 APLNR (0.37) CD81
SCHEMBL20919809 0.70 TSHR (0.53)
SCHEMBL1443386 0.69 SLC1A2 (0.36)
SCHEMBL10476965 0.69 MEN1 (0.33) CYP3A4

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed