SCHEMBL7961865

SCHEMBL7961865

CCC(=Cc1ccccc1CCCc1cccc(C)c1OCc1ccccc1)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 9/20 0.69
PTGER3 P43115 9/20 0.69
PTGER2 P43116 9/20 0.69
PTGER1 P34995 6/20 0.62
PTGES O14684 3/20 0.44
ALOX5 P09917 3/20 0.44
LTB4R Q15722 3/20 0.42
LTB4R2 Q9NPC1 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.38
PPARG P37231 2/20 0.37
BCHE P06276 2/20 0.37
PSEN1 P49768 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37

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
SCHEMBL7805997 0.82 PTGER4 (0.73) PTGER4PTGER3PTGER2PTGER1BCHE
SCHEMBL7798336 0.81 PTGER3 (1.00) PTGER4PTGER3PTGER2PTGER1
SCHEMBL7798340 0.81 PTGER3 (1.00) PTGER4PTGER3PTGER2PTGER1
SCHEMBL7961860 0.80 PTGER3 (0.80) PTGER4PTGER3PTGER2PTGER1ALOX5
SCHEMBL7961856 0.80 PTGER3 (0.80) PTGER4PTGER3PTGER2PTGER1ALOX5
SCHEMBL7947922 0.79 PTGER3 (0.82) PTGER4PTGER3PTGER2PTGER1RXRA
SCHEMBL7807171 0.77 PTGER4 (0.73) PTGER4PTGER3PTGER2PTGER1L3MBTL1
SCHEMBL7955267 0.77 PTGER4 (1.00) PTGER4PTGER3PTGER2PTGER1
SCHEMBL7961858 0.77 PTGER4 (0.62) PTGER4PTGER3PTGER2PTGER1L3MBTL1
SCHEMBL24587500 0.72 ALDH1A1 (0.44) PTGESALOX5L3MBTL1PPARG

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-6211197-B1 CARBOXYLIC ACID OR TETRAZOLE DERIVATES; ANALGESICS, ANTIPYRETICS, AND ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION MERCK FROSST CANADA & CO. (CA) 2001-04-03 US disclosed