SCHEMBL3928708

SCHEMBL3928708

Cc1ccc(S(=O)(=O)N2CCN(Cc3cc(CC(=O)O)ccc3OCCc3ccccc3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 4/20 0.54
TP53 P04637 3/20 0.50
ALDH1A1 P00352 7/20 0.49
KDM4E B2RXH2 5/20 0.49
STAT3 P40763 1/20 0.49
POLB P06746 1/20 0.49
PKM P14618 2/20 0.49
GAA P10253 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL3932364 0.91 PTGDR2 (0.55) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3931978 0.88 MEN1 (0.54) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3926126 0.88 PTGDR2 (0.49) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3925781 0.86 TP53 (0.54) TP53ALDH1A1KDM4EPOLBPKM
SCHEMBL4106390 0.86 KDM4E (0.63) TP53ALDH1A1KDM4ESTAT3POLB
SCHEMBL3928769 0.86 PTGDR2 (0.61) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3929149 0.85 PTGDR2 (0.51) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3925705 0.85 PTGDR2 (0.50) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3929213 0.84 MEN1 (0.50) PTGDR2TP53ALDH1A1KDM4ESTAT3
SCHEMBL3937820 0.84 PTGDR2 (0.58) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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