SCHEMBL4013799

SCHEMBL4013799

COC(=O)Cc1cccc(-c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.59
L3MBTL1 Q9Y468 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
PLK1 P53350 1/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CTSG P08311 1/20 0.46
CMA1 P23946 1/20 0.46
CTSL P07711 1/20 0.46
ALOX5 P09917 1/20 0.46
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL4018010 0.92 HTR6 (0.50) HTR6L3MBTL1MEN1KMT2ACA12
SCHEMBL4007511 0.92 L3MBTL1 (0.50) HTR6L3MBTL1MEN1KMT2ACA12
SCHEMBL4019486 0.88 HPGD (0.51) HTR6L3MBTL1MEN1KMT2AMAPT
SCHEMBL4014015 0.88 HTR6 (0.66) HTR6L3MBTL1MEN1KMT2ACA12
SCHEMBL4012211 0.88 HTR6 (0.54) HTR6L3MBTL1MEN1KMT2ACA12
SCHEMBL4016525 0.87 HTR6 (0.53) HTR6L3MBTL1MEN1KMT2ACA12
SCHEMBL4016754 0.85 L3MBTL1 (0.54) HTR6L3MBTL1MEN1KMT2ACA12
SCHEMBL4011279 0.83 L3MBTL1 (0.69) HTR6L3MBTL1CA12CA1CA2
SCHEMBL4014386 0.81 HTR6 (0.56) HTR6L3MBTL1CA12CA1CA2
SCHEMBL3933164 0.78 KDM4E (0.48) HTR6L3MBTL1MAPTHPGDTSHR

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
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