SCHEMBL3933952

SCHEMBL3933952

Cc1ccc(S(=O)(=O)N2CCN(Cc3cc(CC(=O)O)ccc3OCc3ccc(Cl)cc3Cl)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 6/20 0.58
TP53 P04637 1/20 0.48
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
STAT3 P40763 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 1/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL3937820 0.92 PTGDR2 (0.58) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3931978 0.89 MEN1 (0.54) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3937365 0.88 PTGDR2 (0.53) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3928788 0.88 PTGDR2 (0.63) PTGDR2ALDH1A1SMN1; SMN2TDP1
SCHEMBL3932364 0.87 PTGDR2 (0.55) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL14367479 0.86 KMT2A (0.43) PTGDR2ALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL3929256 0.85 PTGDR2 (0.58) PTGDR2TP53ALDH1A1SMN1; SMN2TDP1
SCHEMBL3929213 0.85 MEN1 (0.50) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3928769 0.85 PTGDR2 (0.61) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3929149 0.85 PTGDR2 (0.51) PTGDR2TP53ALDH1A1KDM4ESTAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101490024-A Substituted phenylacetic acids as DP-2 antagonists ICOS CORP (US) 2009-07-22 CN claimed
EP-2044044-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2009-04-08 EP claimed
WO-2007143745-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-13 WO claimed
CN-101490024-A Substituted phenylacetic acids as DP-2 antagonists ICOS CORP (US) 2009-07-22 CN disclosed
EP-2044044-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2009-04-08 EP disclosed
WO-2007143745-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-13 WO disclosed