Oxazole

Oxazole

SCHEMBL5711296

Oc1ccc(N2CCC(Oc3ccc(OC(F)(F)F)cc3)CC2)cc1.c1cocn1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.48
EPHX2 P34913 3/20 0.42
FAAH O00519 2/20 0.42
AADAC P22760 1/20 0.42
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
CHRM4 P08173 2/20 0.41
FFAR1 O14842 4/20 0.38
LCAT P04180 1/20 0.38
FPR2 P25090 2/20 0.38
PROKR1 Q8TCW9 2/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
FFAR4 Q5NUL3 1/20 0.37
MMP2 P08253 1/20 0.37
MMP13 P45452 1/20 0.37
SCN5A Q14524 1/20 0.36
SCN9A Q15858 1/20 0.36
ACACB O00763 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
SCHEMBL57855 0.87 KCNH2 (0.53) KCNH2EPHX2FAAHAADACPTGS1
SCHEMBL13281330 0.87 KCNH2 (0.53) KCNH2EPHX2FAAHAADACPTGS1
SCHEMBL3036120 0.85 KCNH2 (0.52) KCNH2EPHX2FAAHAADACPTGS1
SCHEMBL15441879 0.83 KCNH2 (0.50) KCNH2EPHX2FAAHAADACPTGS1
SCHEMBL13278969 0.78 KCNH2 (0.53) KCNH2EPHX2FAAHAADACPTGS1
SCHEMBL14405200 0.77 KCNH2 (0.46) KCNH2EPHX2FAAHAADACPTGS1
SCHEMBL2095407 0.77 KCNH2 (0.46) KCNH2EPHX2FAAHAADACPTGS1
SCHEMBL3664766 0.75 KCNH2 (0.67) KCNH2EPHX2FAAHAADACPTGS1
SCHEMBL3664769 0.75 KCNH2 (0.67) KCNH2EPHX2FAAHAADACPTGS1
SCHEMBL2056202 0.75 KCNH2 (0.58) KCNH2EPHX2FAAHPTGS1SLC6A2

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-1727782-A1 METHOD OF PRODUCING AMINOPHENOL COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-12-06 EP disclosed
WO-2005092832-A1 METHOD OF PRODUCING AMINOPHENOL COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-10-06 WO disclosed