SCHEMBL7215951

SCHEMBL7215951

CC1=CC[C@H](C2=COC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
CHRNA7 P36544 1/20 0.33
STAT3 P40763 1/20 0.33
TAS2R46 P59540 4/20 0.31
TAS2R31 P59538 2/20 0.31
TAS2R10 Q9NYW0 2/20 0.31

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
SCHEMBL12653184 0.69 LMNA (0.36) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL12152840 0.69 LMNA (0.36) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL9876026 0.67 SRD5A1 (0.43) LMNA
SCHEMBL4136281 0.66
SCHEMBL10280042 0.65 KCNH2 (0.35) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL10660471 0.64 PDE3B (0.38) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL35483 0.63
SCHEMBL31545103 0.63
SCHEMBL11224913 0.62
SCHEMBL7737592 0.61

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
US-6525209-B1 Oxidation of olefins with addition of aldehyde in compressed carbon dioxide solvent; epoxidation; nontoxic, nonexplosive STUDIENGESELLSCHAFT KOHLE MBH (DE) 2003-02-25 US disclosed