SCHEMBL10654907

SCHEMBL10654907

C=CCOc1noc2c1CN(C(=O)OC)CC2

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 4/20 0.47
ERN1 O75460 5/20 0.39
HSP90AA1 P07900 6/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL10655106 0.85 CHRM3 (0.60) CHRM3HSP90AA1HTR2AHTR2C
SCHEMBL10658265 0.83 CHRM3 (0.48) CHRM3HSP90AA1HTR2AHTR2C
SCHEMBL10655470 0.82 CHRM3 (0.58) CHRM3HSP90AA1HTR2C
SCHEMBL10654860 0.82 CHRM3 (0.48) CHRM3HSP90AA1HTR2AHTR2C
SCHEMBL10655542 0.81 CHRM3 (0.46) CHRM3HSP90AA1HTR2AHTR2C
SCHEMBL10654861 0.79 CHRM3 (0.68) CHRM3HTR2AHTR2C
SCHEMBL10658160 0.79 HTR2A (0.52) CHRM3HSP90AA1HTR2AHTR2C
SCHEMBL10460250 0.79 CHRM3 (0.54) CHRM3HSP90AA1HTR2AHTR2C
SCHEMBL10652190 0.79 CHRM3 (0.42) CHRM3HSP90AA1
SCHEMBL10652885 0.78 CHRM3 (0.45) CHRM3HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0126654-B1 TETRAHYDROISOXAZOLO(4,5-C)PYRIDINE DERIVATIVES AND PREPARATION THEREOF H. LUNDBECK A/S (DK) 1988-05-04 EP disclosed
US-4608378-A Tetrahydroisoxazolo[4,5-c]pyridine derivatives useful in the treatment of malfunctions of the acetylcholine or muscarinic systems H. LUNDBECK A/S (DK) 1986-08-26 US disclosed
EP-0126654-A1 Tetrahydroisoxazolo(4,5-c)pyridine derivatives and preparation thereof H. LUNDBECK A/S (DK) 1984-11-28 EP disclosed