SCHEMBL534010

SCHEMBL534010

CCc1nc2c(Cl)ccc(O)c2c(OC(F)F)c1Cc1ccc(C#N)cc1Cl

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.32
EPHX2 P34913 1/20 0.32
CYP19A1 P11511 1/20 0.31
HTR2A P28223 1/20 0.31
KCNH2 Q12809 1/20 0.31
CRHR1 P34998 1/20 0.31
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30
JAK2 O60674 1/20 0.30
JAK1 P23458 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
SCHEMBL534009 0.89 PTGDR2 (0.32) PTGDR2EPHX2HTR2AKCNH2CRHR1
SCHEMBL534858 0.88 PTGDR2 (0.39) PTGDR2CYP19A1
SCHEMBL533922 0.85 PTGDR2 (0.49) PTGDR2EPHX2TSHR
SCHEMBL533980 0.84 PTGDR2 (0.41) PTGDR2EPHX2LMNAMAPT
SCHEMBL534921 0.77 PTGDR2 (0.49) PTGDR2CYP19A1
SCHEMBL534857 0.77 PTGDR2 (0.39) PTGDR2SMN1; SMN2
SCHEMBL534813 0.73 PTGDR2 (0.58) PTGDR2MAPTTSHR
SCHEMBL534580 0.72 MRGPRX4 (0.35) PTGDR2EPHX2HTR2AKCNH2LMNA
SCHEMBL534686 0.72 PTGDR2 (0.49) PTGDR2LMNAMAPTTSHRSMN1; SMN2
SCHEMBL533987 0.69 AR (0.36) CYP19A1

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