SCHEMBL4014386

SCHEMBL4014386

O=C(O)Cc1cccc(-c2cn(S(=O)(=O)c3ccc(F)cc3)c3ccccc23)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 11/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
CA12 O43570 2/20 0.50
CA9 Q16790 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 2/20 0.44
AKR1C3 P42330 1/20 0.43
AKR1C1 Q04828 1/20 0.43
CTSL P07711 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ELAVL1 Q15717 1/20 0.42
HTR2A P28223 1/20 0.42
HTR7 P34969 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
SCHEMBL4014015 0.92 HTR6 (0.66) HTR6L3MBTL1CA12CA9CA1
SCHEMBL4011279 0.90 L3MBTL1 (0.69) HTR6L3MBTL1CA12CA9CA1
SCHEMBL4007511 0.88 L3MBTL1 (0.50) HTR6L3MBTL1CA12CA9CA1
SCHEMBL4016754 0.87 L3MBTL1 (0.54) HTR6L3MBTL1CA12CA9CA1
SCHEMBL3933164 0.82 KDM4E (0.48) HTR6L3MBTL1LMNA
SCHEMBL4018421 0.81 PLA2G10 (0.42) ELAVL1
SCHEMBL4013799 0.81 HTR6 (0.59) HTR6L3MBTL1CA12CA9CA1
SCHEMBL14366365 0.80 HTR6 (0.60) HTR6L3MBTL1CA12CA9CA1
SCHEMBL1413798 0.79 CXCR4 (0.49) HTR6L3MBTL1CA12CA9CA1
SCHEMBL4013009 0.79 HTR6 (0.58) HTR6L3MBTL1CA12CA9CA1

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