SCHEMBL3974573

SCHEMBL3974573

Cc1c(CC(=O)O)c2ccc(C#N)cn2c1Cc1sccc1S(=O)(=O)c1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 9/20 0.41
NR3C1 P04150 1/20 0.31
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
THRB P10828 1/20 0.30
KMT2A Q03164 1/20 0.30
EIF4EBP1 Q13541 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
SCHEMBL3973410 0.91 PTGDR2 (0.33) PTGDR2MEN1KMT2A
SCHEMBL3968452 0.83 PTGDR2 (0.46) PTGDR2
SCHEMBL3973023 0.74 PTGDR2 (0.66) PTGDR2
SCHEMBL3967751 0.74 PTGDR2 (0.39) PTGDR2MEN1POLBKMT2A
SCHEMBL3967762 0.72 PTGDR2 (0.38) PTGDR2
SCHEMBL3971882 0.72 PTGDR2 (0.46) PTGDR2
SCHEMBL3967120 0.72 PTGDR2 (0.52) PTGDR2
SCHEMBL3974826 0.71 PTGDR2 (0.42) PTGDR2
SCHEMBL3968057 0.71 PTGDR2 (0.59) PTGDR2
SCHEMBL3971980 0.71 PTGDR2 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009044147-A1 INDOLIZINE DERIVATIVES WITH CRTH2 RECEPTOR AFFINITY FOR THE TREATMENT OF INFLAMMATORY DISEASES ARGENTA DISCOVERY LIMITED (GB) 2009-04-09 WO disclosed
WO-2009044147-A1 INDOLIZINE DERIVATIVES WITH CRTH2 RECEPTOR AFFINITY FOR THE TREATMENT OF INFLAMMATORY DISEASES ARGENTA DISCOVERY LIMITED (GB) 2009-04-09 WO disclosed