SCHEMBL8675545

SCHEMBL8675545

CCC(C)C1CCC(C(C)CC)CC1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SHBG P04278 2/20 0.42
HCAR2 Q8TDS4 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL1193150 1.00
SCHEMBL27525646 0.89 SHBG (0.36) SHBG
SCHEMBL132962 0.88
SCHEMBL28154637 0.88 SHBG (0.39) SHBGHCAR2
SCHEMBL1193094 0.88
SCHEMBL23754245 0.87 SHBG (0.39) SHBGHCAR2TSHR
SCHEMBL8415138 0.87 SHBG (0.62) SHBGHCAR2TSHR
SCHEMBL8697317 0.87 SHBG (0.34) SHBG
SCHEMBL22460622 0.87 SHBG (0.34) SHBG
SCHEMBL8840566 0.87 SHBG (0.34) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5759528-A AMINE OXIDE SURFACTANT AND CYCLOHEXANE, CYCLOHEXENE OR CYCLOHEXANONE DERIVATIVE INSTITUTE FOR ADVANCED SKIN RESEARCH, INC. (JP) 1998-06-02 US disclosed
EP-0745389-A1 COMPOSITION FOR TOPICAL APPLICATION INSTITUTE FOR ADVANCED SKIN RESEARCH INC. (JP) 1996-12-04 EP disclosed