SCHEMBL4016525

SCHEMBL4016525

COC(=O)Cc1cc(Cl)cc(-c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 12/20 0.53
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
PLK1 P53350 1/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALOX5 P09917 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 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
SCHEMBL4012211 0.89 HTR6 (0.54) HTR6MEN1KMT2AL3MBTL1CA12
SCHEMBL4013009 0.89 HTR6 (0.58) HTR6MEN1KMT2AL3MBTL1CA12
SCHEMBL4013799 0.87 HTR6 (0.59) HTR6MEN1KMT2AL3MBTL1CA12
SCHEMBL4007511 0.80 L3MBTL1 (0.50) HTR6MEN1KMT2AL3MBTL1CA12
SCHEMBL4018010 0.80 HTR6 (0.50) HTR6MEN1KMT2AL3MBTL1CA12
SCHEMBL14366365 0.77 HTR6 (0.60) HTR6MEN1KMT2AL3MBTL1CA12
SCHEMBL4019486 0.75 HPGD (0.51) HTR6MEN1KMT2AL3MBTL1LMNA
SCHEMBL4014015 0.75 HTR6 (0.66) HTR6MEN1KMT2AL3MBTL1CA12
SCHEMBL4016754 0.72 L3MBTL1 (0.54) HTR6MEN1KMT2AL3MBTL1CA12
SCHEMBL3644542 0.72 HTR6 (1.00) HTR6L3MBTL1CA12CA1CA2

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 3 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 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