SCHEMBL7859294

SCHEMBL7859294

CO/N=C(C(/C)=N/O)\c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.43
LMNA P02545 1/20 0.43
PTBP1 P26599 1/20 0.43
ALDH1A1 P00352 1/20 0.40
TRPA1 O75762 2/20 0.40
CYP1A2 P05177 1/20 0.37
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
TYMP P19971 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
METTL3 Q86U44 1/20 0.33
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33

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
SCHEMBL8499333 1.00 SMN1; SMN2 (0.43) SMN1; SMN2LMNAPTBP1ALDH1A1TRPA1
SCHEMBL6544654 0.84 SMN1; SMN2 (0.42) SMN1; SMN2LMNAPTBP1TRPA1CYP1A2
SCHEMBL8720211 0.82 GSK3B (0.50) SMN1; SMN2LMNAALDH1A1MAPTPOLB
SCHEMBL7609636 0.82 TRPA1 (0.43) SMN1; SMN2LMNAALDH1A1TRPA1CYP1A2
SCHEMBL8501552 0.82 TRPA1 (0.43) SMN1; SMN2LMNAALDH1A1TRPA1CYP1A2
SCHEMBL5597826 0.81 GAA (0.41) SMN1; SMN2LMNAALDH1A1MAPTPOLB
SCHEMBL8460844 0.81 GAA (0.41) SMN1; SMN2LMNAALDH1A1MAPTPOLB
SCHEMBL7522304 0.81 PTGS1 (0.39) SMN1; SMN2LMNAALDH1A1CYP1A2MAPT
SCHEMBL7522306 0.81 PTGS1 (0.39) SMN1; SMN2LMNAALDH1A1CYP1A2MAPT
SCHEMBL6230254 0.78 TRPA1 (0.50) SMN1; SMN2LMNAPTBP1ALDH1A1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820435-B1 METHOD OF PREPARING ESSENTIALLY PURE ISOMERS OF ALPHA-BIS-OXIMES BASF AG (DE) 2001-05-16 EP disclosed
US-5929279-A Preparation of Bisoximes BASF AKTIENGESELLSCHAFT (DE) 1999-07-27 US disclosed
EP-0820435-A1 METHOD OF PREPARING ESSENTIALLY PURE ISOMERS OF $g(a)-BIS-OXIMES BASF AKTIENGESELLSCHAFT (DE) 1998-01-28 EP disclosed
WO-1996032373-A1 METHOD OF PREPARING ESSENTIALLY PURE ISOMERS OF α-BIS-OXIMES BASF AKTIENGESELLSCHAFT (DE) 1996-10-17 WO disclosed