SCHEMBL22250100

SCHEMBL22250100

CC(C)C[S+]([O-])C1CCCCC1

nearest known ligand 0.36

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
SCHEMBL7437882 0.77 REN (0.33)
Hydrochloric Acid SCHEMBL7434448 0.75 REN (0.33)
SCHEMBL23706545 0.74
SCHEMBL23706587 0.74
SCHEMBL776552 0.73 SHBG (0.33) SHBG
SCHEMBL779909 0.70
SCHEMBL14967233 0.70
SCHEMBL18279510 0.70 CYP1A2 (0.34) SHBG
SCHEMBL23706626 0.67
SCHEMBL23706689 0.65

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-2020150675-A1 COMPOUNDS AND USES THEREOF NUVATION BIO INC. (US) 2020-07-23 WO disclosed