SCHEMBL7836764

SCHEMBL7836764

O=C(O)C(=NO)c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
CTBP2 P56545 1/20 0.48
BCL2L1 Q07817 1/20 0.48
BAD Q92934 1/20 0.48
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
GAA P10253 1/20 0.45
CYP2C19 P33261 1/20 0.45
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
PTPN1 P18031 1/20 0.42
LTA4H P09960 1/20 0.41
MITF O75030 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 2/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL7836762 1.00 CES2 (0.50) CES2CES1CTBP2BCL2L1BAD
SCHEMBL30443235 0.83 CES2 (0.62) CES2CES1CTBP2BCL2L1BAD
SCHEMBL5742673 0.81 CES2 (0.48) CES2CES1CTBP2BCL2L1BAD
SCHEMBL5742677 0.81 CES2 (0.48) CES2CES1CTBP2BCL2L1BAD
SCHEMBL11457089 0.80 CPT1B (0.54) CES2CTBP2CA1CA2GAA
SCHEMBL11457091 0.80 CPT1B (0.54) CES2CTBP2CA1CA2GAA
SCHEMBL4454729 0.79 GAA (0.68) CES2CES1CTBP2CA1CA2
SCHEMBL5360093 0.79 GAA (0.68) CES2CES1CTBP2CA1CA2
SCHEMBL11461735 0.79 GAA (0.68) CES2CES1CTBP2CA1CA2
SCHEMBL11453733 0.78 ALDH1A1 (0.54) CES2CES1CTBP2GAACYP2C19

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-1077957-A1 OXYIMINOALKANOIC ACID DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Chemical Industries, Ltd. (JP) 2001-02-28 EP disclosed
WO-1999058510-A1 OXYIMINOALKANOIC ACID DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-18 WO disclosed