SCHEMBL2489612

SCHEMBL2489612

O=C(Nc1cc(-c2cccc(Cl)c2)ccn1)c1ccc(Oc2cc3c(cc2Cl)CCCO3)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 15/20 0.48
GRM5 P41594 3/20 0.41
MAPK14 Q16539 2/20 0.40
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40

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
SCHEMBL2488127 0.93 PTGDR2 (0.49) PTGDR2
SCHEMBL2486854 0.89 PTGDR2 (0.49) PTGDR2GRM5
SCHEMBL2492873 0.89 PTGDR2 (0.46) PTGDR2
SCHEMBL2492708 0.87 PTGDR2 (0.45) PTGDR2GRM5
SCHEMBL2492508 0.87 PTGDR2 (0.48) PTGDR2GRM5
SCHEMBL2490747 0.87 PTGDR2 (0.61) PTGDR2GRM5
SCHEMBL2487257 0.85 PTGDR2 (0.51) PTGDR2GRM5
SCHEMBL2489767 0.85 PTGDR2 (0.44) PTGDR2GRM5
SCHEMBL2489639 0.84 PTGDR2 (0.45) PTGDR2
SCHEMBL2493195 0.83 PTGDR2 (0.45) PTGDR2GRM5

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