SCHEMBL5499201

SCHEMBL5499201

C=CCNC1CC2CCC1CC2

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.34
DPP4 P27487 2/20 0.33
KMT2A Q03164 1/20 0.31
EPHX2 P34913 1/20 0.30

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
SCHEMBL4067246 0.90 DPP4 (0.42) DPP4EPHX2
SCHEMBL17291825 0.70 HTR1A (0.39) HTR1AKMT2A
SCHEMBL5499199 0.68 GAA (0.44) HTR1AKMT2A
SCHEMBL10667378 0.67 MAPT (0.34) EPHX2
SCHEMBL1848674 0.67 TSHR (0.36) HTR1AKMT2A
SCHEMBL1848675 0.67 TSHR (0.36) HTR1AKMT2A
SCHEMBL21316453 0.67 ANPEP (0.42) HTR1AKMT2A
SCHEMBL6390292 0.67 ANPEP (0.42) HTR1AKMT2A
SCHEMBL6390289 0.67 ANPEP (0.42) HTR1AKMT2A
SCHEMBL22744300 0.65 EPHX2 (0.36) KMT2AEPHX2

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-1737854-A1 NOVEL 2-(1-AZA-BICYCLO[2.2.2]OCT-3-yl)-2,3-DIHYDROISOINDOL-l-ONE/5,6-DIHYDRO-FURO[2,3-c]PYRROL-4ONE DERIVATIVES LIGANDS FOR ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR AstraZeneca AB (SE) 2007-01-03 EP disclosed
WO-2005100351-A1 NOVEL 2-(1-AZA-BICYCLO[2.2.2]OCT-3-yl)-2,3-DIHYDROISOINDOL-l-ONE/5,6-DIHYDRO-FURO[2,3-c]PYRROL-4ONE DERIVATIVES LIGANDS FOR ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ASTRAZENECA AB (SE) 2005-10-27 WO disclosed