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SCHEMBL6532744

SCHEMBL6532744

Cc1ccc(N(C)c2ccc(S(=O)(=O)n3c(C)c(CC(=O)O)c4cc(F)ccc43)cc2)cc1

nearest known ligand 0.86

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 16/20 0.86
▸ PTGDR Q13258 6/20 0.74
▸ HTR6 P50406 1/20 0.46
▸ AKR1C3 P42330 2/20 0.45
▸ AKR1C2 P52895 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TBXA2R P21731 1/20 0.44
▸ CCKAR P32238 1/20 0.44

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
SCHEMBL6529582 0.94 PTGDR2 (0.80) PTGDR2PTGDRHTR6AKR1C3AKR1C2
SCHEMBL6529300 0.92 PTGDR2 (0.72) PTGDR2PTGDRAKR1C3AKR1C2TBXA2R
SCHEMBL6529040 0.89 PTGDR2 (0.73) PTGDR2PTGDRCCKAR
SCHEMBL6532462 0.88 PTGDR2 (0.69) PTGDR2PTGDRAKR1C3AKR1C2CCKAR
SCHEMBL6533995 0.88 PTGDR2 (0.73) PTGDR2PTGDRAKR1C3AKR1C2CCKAR
SCHEMBL6532747 0.88 PTGDR2 (0.73) PTGDR2PTGDRHTR6AKR1C3AKR1C2
SCHEMBL6528660 0.87 PTGDR2 (0.68) PTGDR2PTGDRCCKAR
SCHEMBL6529278 0.85 PTGDR2 (0.69) PTGDR2PTGDRCCKAR
SCHEMBL6531237 0.85 PTGDR2 (0.68) PTGDR2PTGDRAKR1C3AKR1C2CCKAR
SCHEMBL6529089 0.85 PTGDR2 (0.68) PTGDR2PTGDRAKR1C3AKR1C2TBXA2R

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
WO-2005040112-A1 COMPOUNDS WITH PGD2 ANTAGONIST ACTIVITY OXAGEN LIMITED (GB) 2005-05-06 — — WO disclosed