SCHEMBL2579240

SCHEMBL2579240

Cc1c(Cc2ccc(-n3cc(Cl)cn3)cc2)c(OC(F)F)nc2c(Cl)ccc([O])c12

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.34
CYP3A4 P08684 1/20 0.32
P2RX7 Q99572 1/20 0.30
GPR4 P46093 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
SCHEMBL2579246 0.89 PTGDR2 (0.34) PTGDR2CYP3A4GPR4
SCHEMBL2580081 0.88 USP1 (0.32) GPR4
SCHEMBL2574953 0.86 PTGDR2 (0.44) PTGDR2
SCHEMBL2570820 0.85 PTGDR2 (0.50) PTGDR2
SCHEMBL2581492 0.83 KCNH2 (0.34)
SCHEMBL2570648 0.82 PTGDR2 (0.41) PTGDR2
SCHEMBL2576048 0.80 PTGDR2 (0.37) PTGDR2GPR4
SCHEMBL2574519 0.80 USP1 (0.33)
SCHEMBL533986 0.80 AR (0.36)
SCHEMBL2570608 0.78 KCNH2 (0.36) 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-2139881-B1 QUINOLINES AND THEIR THERAPEUTIC USE PULMAGEN THERAPEUTICS ASTHMA LTD (GB) 2011-11-09 EP claimed