SCHEMBL6208261

SCHEMBL6208261

COC(=O)c1ccc(=O)n(O)c1.O=C(OC(=O)C(F)(F)F)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
NOTUM Q6P988 2/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA12 O43570 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
IDH1 O75874 1/20 0.36
TSHR P16473 1/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
XDH P47989 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL2068258 0.86 LMNA (0.51) LMNAKDM4EGAACA1CA2
SCHEMBL31133024 0.74 LMNA (0.57) LMNAKDM4EGAANOTUMCA1
SCHEMBL1255539 0.72 LMNA (0.62) LMNAKDM4EGAACA1CA2
SCHEMBL23562090 0.72 LMNA (0.62) LMNAKDM4EGAACA1CA2
SCHEMBL9339167 0.72 LMNA (0.50) LMNAKDM4EGAACA1CA2
SCHEMBL2034671 0.70 LMNA (0.51) LMNAKDM4EGAACA1CA2
SCHEMBL14406916 0.68 LMNA (0.50) LMNAKDM4EGAACA1CA2
SCHEMBL28192075 0.68 LMNA (0.50) LMNAKDM4EGAACA1CA2
Dimethyl Phthalate SCHEMBL28326550 0.68 TSHR (0.53) LMNAKDM4ECA1CA2CA9
SCHEMBL19190708 0.68 LMNA (0.61) LMNAKDM4EGAACA1CA2

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-1546133-A2 N-SUBSTITUTE-2-OXODIHYDROPYRIDINE DERIVATIVES AS NPY ANTAGONISTS BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-06-29 EP disclosed
WO-2004031175-A2 N-SUBSTITUTED-2-OXODIHYDROPYRIDINE DERIVATIVES AS NPY ANTAGONISTS BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-04-15 WO disclosed