SCHEMBL9629396

SCHEMBL9629396

CCOC(C)OCC.O=Cc1ncccc1Oc1ncccn1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
NFE2L2 Q16236 1/20 0.32
GRM5 P41594 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30

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
SCHEMBL9628403 0.86 CTSA (0.41) SMN1; SMN2
SCHEMBL9627618 0.79 ALDH1A1 (0.36) LMNAALDH1A1KDM4EMEN1HTT
SCHEMBL934218 0.76 GRM5 (0.45) LMNAALDH1A1MEN1HTTKMT2A
SCHEMBL8752083 0.73 LMNA (0.44) LMNAALDH1A1KDM4ESMN1; SMN2NPC1
SCHEMBL9629432 0.72 CTSA (0.41) ALDH1A1SMN1; SMN2
SCHEMBL933809 0.71 MEN1 (0.43) LMNAALDH1A1KDM4EMEN1KMT2A
SCHEMBL24323463 0.70 NFE2L2 (0.40) ALDH1A1SMN1; SMN2HTTNFE2L2NPC1
SCHEMBL871658 0.70 GRM5 (0.43) LMNAALDH1A1KDM4ESMN1; SMN2MEN1
SCHEMBL29601108 0.70 NFE2L2 (0.40) ALDH1A1SMN1; SMN2HTTNFE2L2NPC1
SCHEMBL1536639 0.70 NCF1 (0.43) LMNAALDH1A1KDM4ESMN1; SMN2HTT

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-0435186-A2 Pyridyloxypyrimidine derivatives, preparation process thereof, and herbicidal compositions containing the same as active ingredients MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-07-03 EP claimed
US-5129937-A Pre- and postemergence; soybean, cotton, corn; injury free MITSUI TOATSU CHEMICALS INCORPORATED (JP) 1992-07-14 US disclosed
EP-0435186-A2 Pyridyloxypyrimidine derivatives, preparation process thereof, and herbicidal compositions containing the same as active ingredients MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-07-03 EP disclosed