SCHEMBL534006

SCHEMBL534006

CCc1nc2c(F)ccc([O])c2c(OC(F)F)c1Cc1ccc(NC(=O)OC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.50
FAAH O00519 1/20 0.33
DHFR P00374 2/20 0.32
MAPT P10636 3/20 0.32
MMP9 P14780 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
CCNB2 O95067 2/20 0.31
CDK1 P06493 2/20 0.31
CCNB1 P14635 2/20 0.31
CCNB3 Q8WWL7 2/20 0.31
CCNE2 O96020 1/20 0.31
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
HTT P42858 1/20 0.30
THRB P10828 1/20 0.30
CDK5 Q00535 1/20 0.30

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
SCHEMBL534794 0.84 PTGDR2 (0.51) PTGDR2CCNE2CCNE1CDK2
SCHEMBL534080 0.83 PTGDR2 (0.51) PTGDR2
SCHEMBL534920 0.81 PTGDR2 (0.49) PTGDR2SMN1; SMN2
SCHEMBL2572569 0.80 PTGDR2 (0.56) PTGDR2CCNB2CDK1CCNB1CCNB3
SCHEMBL19614973 0.77 PTGDR2 (0.44) PTGDR2DHFRCCNB2CDK1CCNB1
SCHEMBL2574709 0.76 PTGDR2 (0.58) PTGDR2MAPTLMNASMN1; SMN2HTT
SCHEMBL534118 0.76 PTGDR2 (0.55) PTGDR2DHFRP2RX3
SCHEMBL2573403 0.75 PTGDR2 (0.67) PTGDR2MAPTLMNASMN1; SMN2HTT
SCHEMBL3782624 0.75 PTGDR2 (0.63) PTGDR2DHFRMAPTALDH1A1SMN1; SMN2
SCHEMBL2572551 0.74 PTGDR2 (0.62) PTGDR2ALDH1A1HTT

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-2129661-B1 QUINOLINE DERIVATIVES AS CRTH2 RECEPTOR LIGANDS PULMAGEN THERAPEUTICS ASTHMA LTD (GB) 2012-02-08 EP claimed