SCHEMBL4275437

SCHEMBL4275437

O=C(O)CCCOc1ccc(F)c(CCCc2cc(C(c3ccc(F)cc3)c3ccc(F)cc3)c[nH]c2=O)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 8/20 0.39
FFAR1 O14842 5/20 0.39
PTGDR2 Q9Y5Y4 4/20 0.39
CNR1 P21554 1/20 0.39
LTB4R Q15722 2/20 0.38
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
PPARD Q03181 1/20 0.35
PTGDR Q13258 1/20 0.35
LTA4H P09960 1/20 0.34

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
SCHEMBL4276043 0.93 PTGDR2 (0.43) FFAR4FFAR1PTGDR2CNR1PPARG
SCHEMBL4270407 0.83 PTGDR2 (0.41) FFAR1PTGDR2PPARGPPARD
SCHEMBL4283671 0.80 FFAR4 (0.38) FFAR4FFAR1PTGDR2CNR1LTB4R
SCHEMBL3172653 0.79 PTGDR2 (0.64) FFAR4FFAR1PTGDR2CNR1LTB4R
SCHEMBL4268388 0.77 PTGDR2 (0.42) PTGDR2PPARGPPARA
SCHEMBL4277978 0.76 DAO (0.34) PTGDR2PPARGPPARA
SCHEMBL3180242 0.75 PTGDR2 (0.64) FFAR4FFAR1PTGDR2LTB4RPPARG
SCHEMBL4274009 0.75 PTGDR2 (0.55) FFAR1PTGDR2PTGDR
SCHEMBL4268576 0.75 PTGDR2 (0.46) FFAR4FFAR1PTGDR2LTB4RPTGDR
SCHEMBL4271758 0.74 PTGDR2 (0.47) FFAR4FFAR1PTGDR2PTGDR

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-2094662-A1 POLYCYCLIC ACID COMPOUNDS USEFUL AS CRTH2 ANTAGONISTS AND ANTIALLERGIC AGENTS Astellas Pharma Inc. (JP) 2009-09-02 EP disclosed
WO-2008072784-A1 POLYCYCLIC ACID COMPOUNDS USEFUL AS CRTH2 ANTAGONISTS AND ANTIALLERGIC AGENTS ASTELLAS PHARMA INC. (JP) 2008-06-19 WO disclosed