SCHEMBL2487326

SCHEMBL2487326

O=C(Nc1ccc2cc(C(F)(F)F)ccc2n1)c1ccc(Oc2cc3c(cc2Cl)CCCO3)cc1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 18/20 0.45
PIR O00625 1/20 0.41
HSF1 Q00613 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
SCHEMBL2493195 0.86 PTGDR2 (0.45) PTGDR2
SCHEMBL2487972 0.84 PTGDR2 (0.51) PTGDR2
SCHEMBL2132255 0.83 PTGDR2 (0.66) PTGDR2
SCHEMBL17818083 0.82 PTGDR2 (0.53) PTGDR2
SCHEMBL13273326 0.82 PTGDR2 (0.58) PTGDR2
SCHEMBL2487269 0.79 PTGDR2 (0.51) PTGDR2
SCHEMBL2489822 0.78 PTGDR2 (0.43) PTGDR2
SCHEMBL2489821 0.78 PTGDR2 (0.69) PTGDR2
SCHEMBL2489689 0.77 PTGDR2 (0.62) PTGDR2
SCHEMBL2489819 0.77 PTGDR2 (0.50) PTGDR2

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
EP-2379535-A1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES Array Biopharma Inc. (US) 2011-10-26 EP disclosed