SCHEMBL5134223

SCHEMBL5134223

C=CC(O)CCCCC.CCCCCC/C=C\O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.47
GPR132 Q9UNW8 1/20 0.47
ABCG2 Q9UNQ0 2/20 0.46
PTGS1 P23219 1/20 0.46
OPRK1 P41145 1/20 0.46
MEN1 O00255 1/20 0.45
CYP3A4 P08684 1/20 0.45
KMT2A Q03164 1/20 0.45
FFAR1 O14842 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
CACNA2D1 P54289 1/20 0.43
CACNB2 Q08289 1/20 0.43
CACNA1C Q13936 1/20 0.43
TSHR P16473 1/20 0.41
GMNN O75496 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL5134222 1.00 PPARG (0.47) PPARGGPR132ABCG2PTGS1OPRK1
SCHEMBL5134225 1.00 PPARG (0.47) PPARGGPR132ABCG2PTGS1OPRK1
SCHEMBL11391305 0.91 FFAR1 (0.51) PPARGGPR132ABCG2PTGS1OPRK1
SCHEMBL6050380 0.85 MAPT (0.50) CYP3A4FFAR1FFAR4TSHRGMNN
SCHEMBL11430050 0.85 MAPT (0.50) CYP3A4FFAR1FFAR4TSHRGMNN
SCHEMBL811911 0.85 MAPT (0.50) CYP3A4FFAR1FFAR4TSHRGMNN
SCHEMBL6050150 0.85 MAPT (0.50) CYP3A4FFAR1FFAR4TSHRGMNN
SCHEMBL5999936 0.85 MAPT (0.50) CYP3A4FFAR1FFAR4TSHRGMNN
SCHEMBL20610561 0.85 MAPT (0.50) CYP3A4FFAR1FFAR4TSHRGMNN
SCHEMBL184105 0.85 MAPT (0.50) CYP3A4FFAR1FFAR4TSHRGMNN

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-1922398-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-05-21 EP disclosed
WO-2007028477-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed