SCHEMBL6855916

SCHEMBL6855916

CCCC(CC1CC(O)CC[C@@H]1CC)[C@H](C)CCC(C)CC

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SHBG P04278 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
SCHEMBL12166908 0.72 SHBG (0.38) SHBG
SCHEMBL6855924 0.72 SHBG (0.38) SHBG
SCHEMBL6855549 0.71 SHBG (0.34) SHBG
SCHEMBL6853904 0.71 SHBG (0.41) SHBG
SCHEMBL12166602 0.68 SHBG (0.36) SHBG
SCHEMBL6856573 0.67 SHBG (0.37) SHBG
SCHEMBL12166639 0.65 CA1 (0.43) SHBG
SCHEMBL12166647 0.63 CA1 (0.38) SHBG
SCHEMBL6856302 0.63
SCHEMBL12166543 0.62 CNR2 (0.42)

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-2011078413-A1 SEVEN-MEMBERED RING COMPOUND AND PHARMACEUTICAL USE THEREFOR 第一三共株式会社 (JP) 2011-06-30 WO disclosed