SCHEMBL9806327

SCHEMBL9806327

O=C1CCC2C(CCC3CCC[C@@H]32)C1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SHBG P04278 3/20 0.43
MAPK1 P28482 1/20 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
SCHEMBL9806329 1.00 SHBG (0.43) SHBGMAPK1
SCHEMBL9806286 1.00 SHBG (0.43) SHBGMAPK1
SCHEMBL12920844 0.96 SHBG (0.48) SHBG
SCHEMBL17538675 0.96 SHBG (0.48) SHBG
SCHEMBL12920848 0.96 SHBG (0.48) SHBG
SCHEMBL11224788 0.96 SHBG (0.43) SHBG
SCHEMBL17269241 0.92 SHBG (0.48) SHBG
SCHEMBL11787039 0.89 SHBG (0.49) SHBG
SCHEMBL25568744 0.87 SHBG (0.44) SHBG
SCHEMBL9806333 0.81 SHBG (0.32) SHBG

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
EP-0301907-B1 NOVEL SUBSTITUTED ANTHRASTEROID DERIVATES, THEIR PRODUCTION AND USE SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1991-04-17 EP disclosed