SCHEMBL23131069

SCHEMBL23131069

CC/C=N/N(C)C(=O)OCC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.37
ALDH1A1 P00352 5/20 0.36
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALOX15 P16050 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
SOAT1 P35610 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL23131256 0.77 HDAC6 (0.35) CA12CA1MAPT
SCHEMBL102165 0.74
SCHEMBL23353727 0.74
SCHEMBL8382484 0.71 ALDH1A1 (0.42) CYP2C9ALDH1A1LMNAHSD17B10MEN1
SCHEMBL4658852 0.71
SCHEMBL15078810 0.69
SCHEMBL20732886 0.69 CA1 (0.33) ALDH1A1CA1CA2SMN1; SMN2
SCHEMBL6009969 0.68 ALDH1A1 (0.50) CYP2C9ALDH1A1LMNAHSD17B10MEN1
SCHEMBL20870669 0.68 ALDH1A1 (0.50) CYP2C9ALDH1A1LMNAHSD17B10MEN1
SCHEMBL1201195 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3414238-B1 SUBSTITUTED IMIDAZOLYL-CARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2021-03-24 EP disclosed