SCHEMBL2489044

SCHEMBL2489044

O=C(Nc1cncc(-c2ccc(Cl)cc2)c1)c1ccc(Oc2cc3c(cc2Cl)CCCO3)cc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 16/20 0.49
PNLIP P16233 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.41
POLB P06746 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
SCHEMBL2489767 0.91 PTGDR2 (0.44) PTGDR2NPC1RAB9A
SCHEMBL2489819 0.86 PTGDR2 (0.50) PTGDR2NPC1RAB9A
SCHEMBL2492872 0.86 PTGDR2 (0.50) PTGDR2PNLIPNPC1RAB9APOLB
SCHEMBL2492752 0.86 PTGDR2 (0.56) PTGDR2
SCHEMBL2489963 0.84 PTGDR2 (0.50) PTGDR2PNLIPNPC1RAB9APOLB
SCHEMBL2488127 0.84 PTGDR2 (0.49) PTGDR2POLB
SCHEMBL1569811 0.83 PTGDR2 (0.69) PTGDR2PNLIPNPC1RAB9APOLB
SCHEMBL2489986 0.83 PTGDR2 (0.53) PTGDR2NPC1RAB9A
SCHEMBL2490235 0.82 PTGDR2 (0.53) PTGDR2
SCHEMBL2132320 0.82 PTGDR2 (0.73) 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