SCHEMBL3937652

SCHEMBL3937652

CCc1ccc(S(=O)(=O)N2CCCC(c3cccc(CC(=O)O)c3)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 1/20 0.49
TP53 P04637 1/20 0.48
BCL9 O00512 7/20 0.48
CTNNB1 P35222 7/20 0.48
USP5 P45974 1/20 0.45
AKR1C3 P42330 1/20 0.44
AKR1C1 Q04828 1/20 0.44
CYP2C19 P33261 1/20 0.44
DRD2 P14416 1/20 0.44
DRD3 P35462 1/20 0.44
HSD11B1 P28845 1/20 0.44
ATM Q13315 1/20 0.44
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL3932070 0.91 ALDH1A1 (0.50) MEN1KMT2AALDH1A1BCL9CTNNB1
SCHEMBL3930676 0.91 BCL9 (0.49) MEN1KMT2ABCL9CTNNB1USP5
SCHEMBL3941700 0.91 BCL9 (0.54) MEN1KMT2AALDH1A1BCL9CTNNB1
SCHEMBL3936472 0.89 TP53 (0.48) MEN1KMT2AALDH1A1TP53BCL9
SCHEMBL3938045 0.89 MAPT (0.55) MEN1KMT2AALDH1A1TP53BCL9
SCHEMBL14366755 0.89 MEN1 (0.48) MEN1KMT2ABCL9CTNNB1USP5
SCHEMBL3941517 0.89 MAPT (0.55) MEN1KMT2AALDH1A1TP53BCL9
SCHEMBL3929084 0.89 MAPT (0.55) MEN1KMT2AALDH1A1TP53BCL9
SCHEMBL4110985 0.89 SMN1; SMN2 (0.48) MEN1KMT2ABCL9CTNNB1USP5
SCHEMBL3932074 0.88 BCL9 (0.58) MEN1KMT2AALDH1A1BCL9CTNNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044017-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2009-04-08 EP claimed
WO-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO claimed
EP-2044017-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2009-04-08 EP disclosed
WO-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO disclosed
WO-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO disclosed