SCHEMBL9404483

SCHEMBL9404483

O=C(OCc1cc(C2=C(Cl)CCNC2)no1)C(=O)OCc1cc(C2=C(Cl)CCNC2)no1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
L3MBTL1 Q9Y468 4/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
RAB9A P51151 2/20 0.32
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
STAT3 P40763 1/20 0.32
STAT1 P42224 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.31
POLB P06746 2/20 0.31
NOTUM Q6P988 1/20 0.31
JAK2 O60674 1/20 0.30
ALDH1A1 P00352 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
Oxalic Acid SCHEMBL9404274 0.84 CHRNB2 (0.34) MAPTCHRNB2CHRNA4SLC6A2SLC6A4
Oxalic Acid SCHEMBL9404480 0.81 NOTUM (0.43) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3
Oxalic Acid SCHEMBL9404430 0.77 CHRNB2 (0.43) CHRNB2CHRNA4L3MBTL1SMN1; SMN2POLB
Oxalic Acid SCHEMBL9404355 0.76 PPARA (0.41) MAPTCHRNB2CHRNA4SLC6A2SLC6A4
Oxalic Acid SCHEMBL9404484 0.73 POLB (0.36) MAPTCHRNA4SLC6A2SLC6A4SLC6A3
Oxalic Acid SCHEMBL9404318 0.64 CHRNA4 (0.31) CHRNA4
Oxalic Acid SCHEMBL9404275 0.64 CHRM2 (0.42) MAPTL3MBTL1RAB9ANPC1MEN1
Oxalic Acid SCHEMBL9404477 0.61 CHRM3 (0.39) MAPTL3MBTL1SMN1; SMN2RAB9ANPC1
SCHEMBL9404369 0.60 ALDH1A1 (0.42) MAPTL3MBTL1RAB9ANPC1MEN1
SCHEMBL9404358 0.60 PPARA (0.37) MAPTSMN1; SMN2RAB9AHPGDSTAT3

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
US-5356912-A 3-(5-isoxazolyl)-1-methyl-1,2,3,6-tetrahydropyridine useful for treating Alzheimer's disease NOVO NORDISK A/S (DK) 1994-10-18 US disclosed
US-5262427-A Cognition activators for Alzheimer*s disease NOVO NORDISK A/S (DK) 1993-11-16 US disclosed