SCHEMBL16244148

SCHEMBL16244148

CC/C=C\CCCOC(N)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.51
NR1I2 O75469 2/20 0.51
PTGS2 P35354 2/20 0.51
PGR P06401 1/20 0.51
PDE4D Q08499 1/20 0.51
ALDH1A1 P00352 5/20 0.49
ALOX15 P16050 3/20 0.49
CYP3A4 P08684 3/20 0.49
HSD17B10 Q99714 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
TSHR P16473 2/20 0.49
LPAR2 Q9HBW0 3/20 0.44
LPAR3 Q9UBY5 3/20 0.44
LPAR1 Q92633 1/20 0.44
F7 P08709 3/20 0.44
CYP19A1 P11511 3/20 0.44
F3 P13726 3/20 0.44
KMT2A Q03164 3/20 0.44
PTGS1 P23219 2/20 0.44
PPARG P37231 2/20 0.44

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
SCHEMBL1416626 0.94 LPAR2 (0.51) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1416629 0.94 LPAR2 (0.51) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1416611 0.92 LPAR2 (0.54) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1416796 0.92 LPAR2 (0.54) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1416733 0.88 ALDH1A1 (0.58) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1416732 0.88 ALDH1A1 (0.58) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1416487 0.88 ALOX15 (0.46) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1416753 0.88 ALOX15 (0.46) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1416484 0.88 ALOX15 (0.46) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL999550 0.83 ADORA3 (0.55) ADORA3NR1I2PTGS2PGRPDE4D

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2755949-B1 FUNGICIDAL 4-SUBSTITUTED-3-{PHENYL[(HETEROCYCLYLMETHOXY)IMINO]METHYL}-1,2,4-OXADIZOL-5(4H)-ONE DERIVATIVES BAYER IP GMBH (DE) 2015-10-21 EP disclosed
US-9090600-B2 Fungicidal 4-substituted-3-{phenyl[(heterocyclylmethoxy)imino]methyl}-1,2,4-oxadizol-5(4H)-one derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-28 US disclosed
US-20140349848-A1 FUNGICIDAL 4-SUBSTITUTED-3--1,2,4-OXADIZOL-5(4H)-ONE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-11-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140349848-A1 FUNGICIDAL 4-SUBSTITUTED-3--1,2,4-OXADIZOL-5(4H)-ONE DERIVATIVES CYP4X1, CYP4B1, CYP4Z1 ADORA3 1822/4885NR1I2 490/4885PTGS2 3783/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.