SCHEMBL7809005

SCHEMBL7809005

Cc1cccc(/C=C/Cc2ccccc2/C=C/C(=O)OC(C)c2ccccc2)c1OC(C)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGER3 P43115 17/20 0.56
▸ PTGER2 P43116 17/20 0.56
▸ PTGER4 P35408 16/20 0.56
▸ PTGER1 P34995 11/20 0.56
▸ HCAR2 Q8TDS4 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ LTB4R Q15722 1/20 0.34
▸ LTB4R2 Q9NPC1 1/20 0.34
▸ TBXA2R P21731 1/20 0.32
▸ PTGDR Q13258 1/20 0.32

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
SCHEMBL7966444 0.91 PTGER3 (0.67) PTGER3PTGER2PTGER4PTGER1HCAR2
SCHEMBL7966447 0.91 PTGER3 (0.67) PTGER3PTGER2PTGER4PTGER1HCAR2
Phenyl Ethanol SCHEMBL7809007 0.88 PTGER3 (0.64) PTGER3PTGER2PTGER4PTGER1HCAR2
SCHEMBL7961831 0.88 PTGER3 (0.56) PTGER3PTGER2PTGER4PTGER1L3MBTL1
Phenyl Ethanol SCHEMBL7809006 0.88 PTGER3 (0.64) PTGER3PTGER2PTGER4PTGER1HCAR2
SCHEMBL9641895 0.78 HCAR2 (0.63) HCAR2L3MBTL1LTB4RLTB4R2
SCHEMBL9641909 0.78 HCAR2 (0.63) HCAR2L3MBTL1LTB4RLTB4R2
SCHEMBL8011005 0.72 NFE2L2 (0.60) HCAR2L3MBTL1
SCHEMBL7957261 0.71 PTGER4 (0.76) PTGER3PTGER2PTGER4PTGER1
SCHEMBL7957258 0.71 PTGER4 (0.76) PTGER3PTGER2PTGER4PTGER1

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-1119542-A1 PROSTAGLANDIN RECEPTOR LIGANDS Merck Frosst Canada & Co. (CA) 2001-08-01 — — EP disclosed
WO-2000020371-A1 PROSTAGLANDIN RECEPTOR LIGANDS MERCK FROSST CANADA & CO. (CA) 2000-04-13 — — WO disclosed
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