SCHEMBL8409884

SCHEMBL8409884

CCc1ccccc1-c1cc(Br)ccc1OCc1ccc(C(=O)O)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.49
PTGER1 P34995 16/20 0.47
CYP2C9 P11712 1/20 0.45
FFAR4 Q5NUL3 1/20 0.44
FOLH1 Q04609 2/20 0.43

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
SCHEMBL8409837 0.85 MRGPRX4 (0.52) RXRAPTGER1
SCHEMBL9276271 0.84 RXRA (0.46) RXRAPTGER1FFAR4FOLH1
SCHEMBL9232709 0.84 RXRA (0.46) RXRAPTGER1FFAR4FOLH1
SCHEMBL8409540 0.81 CCR5 (0.53) PTGER1CYP2C9
SCHEMBL8409883 0.81 PTGER1 (0.53) RXRAPTGER1FFAR4FOLH1
SCHEMBL8409733 0.78 MCL1 (0.53) RXRAPTGER1
SCHEMBL8406653 0.77 RXRA (0.61) RXRAPTGER1CYP2C9
SCHEMBL8406037 0.77 PTGER1 (0.47) PTGER1CYP2C9
SCHEMBL8406807 0.76 CCR5 (0.49) PTGER1
SCHEMBL9227247 0.75 RXRA (0.45) RXRAPTGER1FFAR4

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-0778821-B1 ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF ZENECA LTD (GB) 1999-10-20 EP disclosed
US-5965741-A ANTIINFLAMMATORY, ANTIPYRETIC AND ANTIDIARRHOEAL PROPERTIES ZENECA LIMITED (GB) 1999-10-12 US disclosed