SCHEMBL2492872

SCHEMBL2492872

O=C(Nc1ccc(-c2ccc(Cl)cc2)nc1)c1ccc(Oc2cc3c(cc2Cl)CCCO3)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 10/20 0.50
PNLIP P16233 1/20 0.44
POLB P06746 1/20 0.43
PTPN1 P18031 2/20 0.43
PTPN6 P29350 1/20 0.43
PTPN11 Q06124 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PTPN2 P17706 1/20 0.41
KCNQ3 O43525 2/20 0.41
KCNQ2 O43526 2/20 0.41
KCNE1 P15382 2/20 0.41
KCNQ1 P51787 2/20 0.41
MAOB P27338 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL2489639 0.91 PTGDR2 (0.45) PTGDR2PNLIPPOLBNPC1RAB9A
SCHEMBL2489986 0.89 PTGDR2 (0.53) PTGDR2NPC1RAB9AMEN1KMT2A
SCHEMBL2489963 0.88 PTGDR2 (0.50) PTGDR2PNLIPPOLBNPC1RAB9A
SCHEMBL2489660 0.88 KCNQ3 (0.44) PTGDR2PNLIPPOLBMEN1KMT2A
SCHEMBL2490235 0.86 PTGDR2 (0.53) PTGDR2
SCHEMBL2489044 0.86 PTGDR2 (0.49) PTGDR2PNLIPPOLBNPC1RAB9A
SCHEMBL2489819 0.85 PTGDR2 (0.50) PTGDR2NPC1RAB9AMEN1KMT2A
SCHEMBL2492752 0.85 PTGDR2 (0.56) PTGDR2
SCHEMBL2489822 0.84 PTGDR2 (0.43) PTGDR2KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL1569811 0.84 PTGDR2 (0.69) PTGDR2PNLIPPOLBNPC1RAB9A

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