SCHEMBL9953748

SCHEMBL9953748

CC(C)=CCCC(C)=CCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.56
PPARG P37231 1/20 0.56
PPARA Q07869 1/20 0.56
MAPT P10636 2/20 0.52
PGR P06401 1/20 0.52
HTR1A P08908 1/20 0.52
ADORA3 P0DMS8 1/20 0.52
PTGS1 P23219 1/20 0.52
PDE4A P27815 1/20 0.52
MAPK1 P28482 1/20 0.52
DRD3 P35462 1/20 0.52
SNCA P37840 1/20 0.52
PDE3A Q14432 1/20 0.52
KMT2A Q03164 2/20 0.52
CNR2 P34972 1/20 0.51
VKORC1 Q9BQB6 1/20 0.49
PTPN1 P18031 1/20 0.49
BACE1 P56817 1/20 0.49
CYP3A4 P08684 2/20 0.48
MEN1 O00255 1/20 0.48

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
SCHEMBL793954 1.00 TRPV1 (0.56) TRPV1PPARGPPARAMAPTPGR
SCHEMBL31670205 1.00 TRPV1 (0.56) TRPV1PPARGPPARAMAPTPGR
SCHEMBL17867387 0.98 KMT2A (0.55) TRPV1PPARGPPARAMAPTPGR
SCHEMBL17867386 0.98 KMT2A (0.55) TRPV1PPARGPPARAMAPTPGR
SCHEMBL4996440 0.87 PPARG (0.49) TRPV1PPARGPPARAMAPTPGR
SCHEMBL3088505 0.84 TRPV1 (0.62) TRPV1PPARGPPARAMAPTPGR
SCHEMBL14695430 0.84 TRPV1 (0.62) TRPV1PPARGPPARAMAPTPGR
SCHEMBL3099921 0.84 TRPV1 (0.62) TRPV1PPARGPPARAMAPTPGR
SCHEMBL19664772 0.84 PPARG (0.58) TRPV1PPARGPPARAMAPTKMT2A
SCHEMBL2072104 0.84 KMT2A (0.52) PPARGPPARAMAPTPGRHTR1A

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
EP-2655307-A1 COMPOUNDS CAPABLE OF RELEASING FRAGRANT COMPOUNDS Givaudan SA (CH) 2013-10-30 EP disclosed
WO-2012085287-A1 COMPOUNDS CAPABLE OF RELEASING FRAGRANT COMPOUNDS GIVAUDAN SA (CH) 2012-06-28 WO disclosed