SCHEMBL4016687

SCHEMBL4016687

COC(=O)Cc1cccc(C2=CCCN(C(=O)OC(C)(C)C)C2)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.40
DGAT2 Q96PD7 2/20 0.40
PDK4 Q16654 1/20 0.39
NR1H2 P55055 2/20 0.39
ESR2 Q92731 1/20 0.38
STS P08842 1/20 0.37
NAMPT P43490 1/20 0.37
ACHE P22303 1/20 0.37
MAPK1 P28482 1/20 0.37
SLC7A5 Q01650 1/20 0.37
USP30 Q70CQ3 1/20 0.37
SYK P43405 1/20 0.37
GLS O94925 1/20 0.37
MGAT2 Q10469 1/20 0.36

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
SCHEMBL4019549 0.89 PTGDR2 (0.42) GPR119DGAT2PDK4NR1H2ESR2
SCHEMBL4012261 0.86 SLC7A5 (0.43) DGAT2SLC7A5SYK
SCHEMBL15709719 0.83 PDK4 (0.53) PDK4NAMPT
SCHEMBL21361618 0.81 MGAT2 (0.44) DGAT2PDK4NR1H2ESR2STS
SCHEMBL30952437 0.81 MGAT2 (0.44) DGAT2PDK4NR1H2ESR2STS
SCHEMBL22945388 0.81 USP30 (0.48) GPR119PDK4NR1H2ESR2MAPK1
SCHEMBL31334489 0.80 USP30 (0.45) GPR119DGAT2PDK4NR1H2ESR2
SCHEMBL6352947 0.79 MAPK1 (0.49) GPR119PDK4NR1H2ESR2NAMPT
SCHEMBL31173305 0.79 PDK4 (0.45) GPR119DGAT2PDK4NR1H2ESR2
SCHEMBL25378040 0.79 PDK4 (0.48) PDK4NAMPT

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 2 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 disclosed
WO-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO disclosed