SCHEMBL9404487

SCHEMBL9404487

Cc1cc(C2=C(Cl)CCN(OC(=O)C(=O)ON3CCC(Cl)=C(c4cc(C)on4)C3)C2)no1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.36
HTT P42858 1/20 0.35
NPC1 O15118 5/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 2/20 0.34
ALDH1A1 P00352 3/20 0.32
RAB9A P51151 4/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 2/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EGFR P00533 2/20 0.31
GAA P10253 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
SCHEMBL9404276 0.82 PRMT5 (0.34) NPC1L3MBTL1ALDH1A1RAB9AMAPT
SCHEMBL9404435 0.82 USP30 (0.35) POLB
SCHEMBL9404358 0.81 PPARA (0.37) HTTALDH1A1RAB9AMAPTKMT2A
SCHEMBL9404343 0.74 HTT (0.36) P2RX7HTTNPC1POLBALDH1A1
SCHEMBL9404510 0.74 P2RX7 (0.44) P2RX7NPC1RAB9AKMT2ATSHR
Oxalic Acid SCHEMBL9404484 0.68 POLB (0.36) HTTNPC1L3MBTL1POLBALDH1A1
Oxalic Acid SCHEMBL9404275 0.64 CHRM2 (0.42) HTTNPC1L3MBTL1ALDH1A1RAB9A
SCHEMBL9404456 0.59 CHRM2 (0.39) POLBALDH1A1KMT2AKDM4ETSHR
SCHEMBL11671866 0.57 RAB9A (0.52) P2RX7NPC1L3MBTL1POLBALDH1A1
SCHEMBL8404086 0.54 CHRM1 (0.56)

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