SCHEMBL3716360

SCHEMBL3716360

Cc1c(Cc2scnc2S(=O)(=O)c2ccccc2)c2cc(Cl)ccc2n1CC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.59
AKR1B1 P15121 1/20 0.49

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
SCHEMBL3725457 0.91 PTGDR2 (0.50) PTGDR2AKR1B1
SCHEMBL1467686 0.89 PTGDR2 (0.73) PTGDR2
SCHEMBL1465905 0.85 PTGDR2 (0.58) PTGDR2AKR1B1
SCHEMBL1466415 0.84 PTGDR2 (0.81) PTGDR2AKR1B1
SCHEMBL3716361 0.84 PTGDR2 (0.53) PTGDR2AKR1B1
SCHEMBL1465689 0.80 PTGDR2 (0.61) PTGDR2
SCHEMBL1465410 0.79 PTGDR2 (0.51) PTGDR2AKR1B1
SCHEMBL1467633 0.79 PTGDR2 (0.64) PTGDR2
SCHEMBL1466879 0.78 PTGDR2 (0.57) PTGDR2AKR1B1
SCHEMBL1465630 0.77 PTGDR2 (0.48) PTGDR2AKR1B1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010142934-A1 INDOLE DERIVATIVES AS LIGANDS OF CRTH2 RECEPTORS PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2010-12-16 WO claimed
WO-2010142934-A1 INDOLE DERIVATIVES AS LIGANDS OF CRTH2 RECEPTORS PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2010-12-16 WO disclosed
WO-2010142934-A1 INDOLE DERIVATIVES AS LIGANDS OF CRTH2 RECEPTORS PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2010-12-16 WO disclosed
WO-2010142934-A1 INDOLE DERIVATIVES AS LIGANDS OF CRTH2 RECEPTORS PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2010-12-16 WO disclosed