SCHEMBL3939587

SCHEMBL3939587

CS(=O)(=O)N1CCCC(c2cccc(CC(=O)O)c2)C1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 5/20 0.47
DRD2 P14416 4/20 0.47
DRD1 P21728 1/20 0.46
DRD4 P21917 1/20 0.46
DRD5 P21918 1/20 0.46
BCL9 O00512 1/20 0.44
CTNNB1 P35222 1/20 0.44
ALDH1A1 P00352 2/20 0.43
POLB P06746 1/20 0.43
FABP6 P51161 1/20 0.43
KDM4E B2RXH2 1/20 0.43
JAK1 P23458 1/20 0.42
TYK2 P29597 1/20 0.42

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
SCHEMBL3943769 0.88 DRD2 (0.45) DRD3DRD2DRD1DRD4DRD5
SCHEMBL3930676 0.87 BCL9 (0.49) DRD3DRD2BCL9CTNNB1
SCHEMBL3941700 0.86 BCL9 (0.54) BCL9CTNNB1ALDH1A1
SCHEMBL3933032 0.86 ALDH1A1 (0.54) ALDH1A1POLB
SCHEMBL3933831 0.85 DRD3 (0.47) DRD3DRD2DRD1DRD4DRD5
SCHEMBL3932070 0.85 ALDH1A1 (0.50) DRD3DRD2DRD1DRD4DRD5
SCHEMBL3930804 0.84 DRD2 (0.46) DRD3DRD2DRD1DRD4DRD5
SCHEMBL3937652 0.84 MEN1 (0.50) DRD3DRD2BCL9CTNNB1ALDH1A1
SCHEMBL3939581 0.84 BCL9 (0.52) DRD3DRD2DRD1DRD4DRD5
SCHEMBL3936225 0.84 BCL9 (0.48) DRD3DRD2DRD1DRD4DRD5

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
CN-101490001-A Substituted phenylacetic acids as DP-2 antagonists ICOS CORP (US) 2009-07-22 CN claimed
CN-101490001-A Substituted phenylacetic acids as DP-2 antagonists ICOS CORP (US) 2009-07-22 CN disclosed
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