SCHEMBL17528951

SCHEMBL17528951

CCC(C)C1CC(=O)C(c2c(C)cc(C)cc2C)=C(O)C1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR2F2 P24468 1/20 0.33
TSHR P16473 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
SIRT2 Q8IXJ6 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
SCHEMBL17528930 0.88 ALOX15 (0.30) HCAR2
SCHEMBL11207769 0.86 TSHR (0.33) NR2F2TSHR
SCHEMBL15944254 0.81 KMT2A (0.36)
SCHEMBL15944321 0.80 ALDH1A1 (0.39) TSHR
SCHEMBL15763672 0.80 TSHR (0.31) TSHR
SCHEMBL15763580 0.79 SIRT2 (0.33) SIRT2
SCHEMBL15944320 0.79
SCHEMBL17122134 0.79
SCHEMBL17122184 0.78 NR3C1 (0.31)
SCHEMBL15944251 0.78 DAO (0.31)

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-2713755-B1 CYCLOHEXANONE COMPOUNDS AND HERBICIDES COMPRISING THE SAME SUMITOMO CHEMICAL CO (JP) 2016-02-24 EP disclosed