SCHEMBL9404276

SCHEMBL9404276

COCc1cc(C2=C(Cl)CCN(OC(=O)C(=O)ON3CCC(Cl)=C(c4cc(COC)on4)C3)C2)no1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
NPC1 O15118 8/20 0.33
RAB9A P51151 7/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.31

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
SCHEMBL9404358 0.85 PPARA (0.37) RAB9AKMT2AMEN1MAPTALDH1A1
SCHEMBL9404487 0.82 P2RX7 (0.36) NPC1RAB9AKMT2AL3MBTL1MAPT
Oxalic Acid SCHEMBL9404275 0.82 CHRM2 (0.42) PRMT5WDR77NPC1RAB9AKMT2A
SCHEMBL9404369 0.78 ALDH1A1 (0.42) PRMT5WDR77NPC1RAB9AKMT2A
SCHEMBL9404481 0.77 CHRM1 (0.41) NPC1RAB9AKMT2AMEN1MAPT
Oxalic Acid SCHEMBL9404274 0.73 CHRNB2 (0.34) NPC1RAB9AKMT2AMEN1L3MBTL1
SCHEMBL9404483 0.66 MAPT (0.34) NPC1RAB9AKMT2AMEN1L3MBTL1
SCHEMBL9404523 0.63 RAB9A (0.35) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL9404353 0.63 TP53 (0.40) KMT2AMEN1MAPT
Oxalic Acid SCHEMBL9404438 0.62 SLC6A3 (0.33) NPC1RAB9AKMT2AMEN1L3MBTL1

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
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
EP-0316718-A2 Azacyclic compounds and their preparation and use NOVO NORDISK A/S (DK) 1989-05-24 EP disclosed