SCHEMBL9404352

SCHEMBL9404352

O=C(c1ccccc1)N1CCC(Cl)=C(C=NO)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.43
LMNA P02545 2/20 0.42
ALDH1A1 P00352 1/20 0.42
PTGDR2 Q9Y5Y4 3/20 0.41
BLM P54132 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
GRM5 P41594 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
CYP2C9 P11712 1/20 0.39
PTGS1 P23219 1/20 0.39
MGLL Q99685 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL7817800 0.85 HPGD (0.46) HPGDLMNAALDH1A1PTGDR2BLM
SCHEMBL9625300 0.81 FAAH (0.46) LMNAALDH1A1CYP3A4CYP2D6CYP2C19
SCHEMBL9404562 0.72 PNMT (0.45) HPGDALDH1A1SIGMAR1MEN1KMT2A
SCHEMBL9404436 0.70 MAOA (0.31)
SCHEMBL7469385 0.70 HPGD (0.56) HPGDLMNAALDH1A1PTGDR2BLM
SCHEMBL4279383 0.68 HPGD (0.73) HPGDLMNAALDH1A1CYP3A4CYP2D6
SCHEMBL30277860 0.68 HPGD (0.73) HPGDLMNAALDH1A1CYP3A4CYP2D6
SCHEMBL1114359 0.68 HPGD (0.59) HPGDALDH1A1BLMSIGMAR1
SCHEMBL7397925 0.68 SIGMAR1 (0.49) SIGMAR1MEN1KMT2A
SCHEMBL1171232 0.68 SIGMAR1 (0.49) SIGMAR1MEN1KMT2A

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