SCHEMBL9404353

SCHEMBL9404353

CCCCc1cc(C2=C(Cl)CCN(C(=O)c3ccccc3)C2)no1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GRM5 P41594 5/20 0.38
PTGS1 P23219 1/20 0.37
PPARA Q07869 1/20 0.36
BLM P54132 1/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.36
LMNA P02545 1/20 0.36
DRD2 P14416 2/20 0.35
DRD4 P21917 2/20 0.35
DRD3 P35462 2/20 0.35

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
SCHEMBL9404261 0.87 NOTUM (0.44) HTTGRM5PTGS1PTGDR2
SCHEMBL9404369 0.85 ALDH1A1 (0.42) MEN1MAPTHTTKMT2AGRM5
SCHEMBL9404357 0.85 USP30 (0.41) MAPTGRM5PTGS1PTGDR2LMNA
SCHEMBL9404510 0.82 P2RX7 (0.44) MEN1KMT2ANPSR1GRM5PTGS1
SCHEMBL9404358 0.78 PPARA (0.37) TP53MEN1MAPTHTTKMT2A
Oxalic Acid SCHEMBL9404355 0.72 PPARA (0.41) MEN1MAPTHTTKMT2APPARA
SCHEMBL7818013 0.68 HPGD (0.42) HTTGRM5PTGS1PTGDR2LMNA
SCHEMBL4024354 0.67 SMN1; SMN2 (0.51) TP53MEN1MAPTHTTKMT2A
SCHEMBL9404328 0.67 KDM4E (0.36) MEN1MAPTHTTKMT2AGRM5
SCHEMBL28680089 0.67 NOTUM (0.60) MAPTLMNADRD2DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0316718-B1 AZACYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1993-09-15 EP claimed
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-B1 AZACYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1993-09-15 EP disclosed
EP-0316718-A2 Azacyclic compounds and their preparation and use NOVO NORDISK A/S (DK) 1989-05-24 EP disclosed