SCHEMBL3932364

SCHEMBL3932364

Cc1ccc(S(=O)(=O)N2CCN(Cc3cc(CC(=O)O)ccc3OCc3ccccc3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 4/20 0.55
TP53 P04637 3/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 6/20 0.51
KDM4E B2RXH2 4/20 0.51
PKM P14618 2/20 0.51
GAA P10253 2/20 0.51
STAT3 P40763 1/20 0.51
POLB P06746 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL3931978 0.97 MEN1 (0.54) PTGDR2TP53MEN1KMT2AALDH1A1
SCHEMBL3929213 0.93 MEN1 (0.50) PTGDR2TP53MEN1KMT2AALDH1A1
SCHEMBL3928769 0.93 PTGDR2 (0.61) PTGDR2TP53MEN1KMT2AALDH1A1
SCHEMBL3937820 0.93 PTGDR2 (0.58) PTGDR2TP53MEN1KMT2AALDH1A1
SCHEMBL3928218 0.92 ALDH1A1 (0.51) PTGDR2TP53MEN1KMT2AALDH1A1
SCHEMBL3928709 0.92 TP53 (0.55) PTGDR2TP53MEN1KMT2AALDH1A1
SCHEMBL3928708 0.91 PTGDR2 (0.54) PTGDR2TP53ALDH1A1KDM4EPKM
SCHEMBL3931983 0.90 MEN1 (0.48) PTGDR2TP53MEN1KMT2AALDH1A1
SCHEMBL3932032 0.90 ALDH1A1 (0.49) PTGDR2MEN1KMT2AALDH1A1KDM4E
SCHEMBL3936773 0.90 PTGDR2 (0.60) PTGDR2MEN1KMT2AALDH1A1KDM4E

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