SCHEMBL11215904

SCHEMBL11215904

C1=NCCC(NCc2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 4/20 0.51
ACHE P22303 7/20 0.47
BACE1 P56817 7/20 0.47
BCHE P06276 5/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
RAB9A P51151 1/20 0.47
FYN P06241 1/20 0.44
OPRM1 P35372 2/20 0.43
OPRL1 P41146 2/20 0.43
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
KDM1A O60341 1/20 0.40
MAOA P21397 1/20 0.40

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
SCHEMBL1373877 0.83 GRIN2B (0.50) GRIN2BACHEBACE1BCHEMEN1
SCHEMBL5347556 0.79 GRIN2B (0.62) GRIN2BACHEBACE1BCHEMEN1
SCHEMBL2092320 0.76 GRIN2B (0.54) GRIN2BACHEBACE1BCHEMEN1
SCHEMBL663239 0.76 GRIN2B (0.74) GRIN2BACHEBACE1BCHEMEN1
Hydrochloric Acid SCHEMBL2550113 0.74 MEN1 (0.78) GRIN2BACHEBACE1BCHEMEN1
SCHEMBL73496 0.74 CARM1 (0.37) MEN1KMT2ARAB9ACARM1PRMT6
SCHEMBL4173336 0.72 GRIN2B (0.69) GRIN2BACHEBACE1BCHEMEN1
SCHEMBL2954218 0.72 GRIN2B (0.69) GRIN2BACHEBACE1BCHEMEN1
SCHEMBL433970 0.72 GRIN2B (0.69) GRIN2BACHEBACE1BCHEMEN1
SCHEMBL24574127 0.71 HRH3 (0.71) GRIN2BACHEBACE1BCHEMEN1

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
EP-0004358-B1 N-OXACYCLYLALKYL PIPERIDINES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS CIBA-GEIGY AG (CH) 1982-01-06 EP disclosed
EP-0004358-A1 N-oxacyclylalkyl piperidines, process for their preparation, pharmaceutical compositions containing these compounds CIBA-GEIGY AG (CH) 1979-10-03 EP disclosed