SCHEMBL5011869

SCHEMBL5011869

CCCCC(CCc1ccccc1)C(=O)O.O=C(O)/C=C/c1ccccc1CCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 6/20 0.47
PTGER2 P43116 6/20 0.47
MMP2 P08253 5/20 0.47
MMP3 P08254 5/20 0.47
PTGER4 P35408 5/20 0.47
PTGES O14684 4/20 0.47
ALOX5 P09917 4/20 0.47
PPARG P37231 4/20 0.47
TBXA2R P21731 3/20 0.44
PTGDR Q13258 3/20 0.44
PTGFR P43088 2/20 0.42
PTGER1 P34995 1/20 0.41
PTGIR P43119 1/20 0.41
AKR1C3 P42330 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
SCHEMBL473644 0.82 MMP2 (0.61) MMP2MMP3PTGESALOX5PPARG
SCHEMBL18076297 0.82 PTGER3 (0.58) PTGER3PTGER2PTGER4TBXA2RPTGDR
SCHEMBL1716822 0.82 PTGER3 (0.58) PTGER3PTGER2PTGER4TBXA2RPTGDR
SCHEMBL1542126 0.79 PTGER3 (0.56) PTGER3PTGER2PTGER4PPARGTBXA2R
SCHEMBL8702148 0.79 PTGER3 (0.56) PTGER3PTGER2PTGER4PPARGTBXA2R
SCHEMBL7530108 0.79 PTGER3 (0.56) PTGER3PTGER2PTGER4PPARGTBXA2R
SCHEMBL16339260 0.78 PTGER3 (0.55) PTGER3PTGER2MMP2PTGER4PPARG
SCHEMBL16339259 0.78 PTGER3 (0.55) PTGER3PTGER2MMP2PTGER4PPARG
SCHEMBL8904812 0.78 MMP2 (0.56) MMP2MMP3PTGESALOX5PPARG
SCHEMBL3684323 0.77 PTGER3 (0.54) PTGER3PTGER2MMP2PTGER4PPARG

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