SCHEMBL10653028

SCHEMBL10653028

COc1noc2c1CN(C(C)=O)CC2

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 5/20 0.60
HTR2C P28335 1/20 0.45
SHMT2 P34897 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
CHRM1 P11229 1/20 0.42
BAZ2B Q9UIF8 1/20 0.39
HSP90AA1 P07900 3/20 0.37
CREBBP Q92793 3/20 0.37
BRD4 O60885 1/20 0.37
NOTUM Q6P988 1/20 0.36
EP300 Q09472 2/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 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
SCHEMBL11115776 0.88 CHRM3 (0.60) CHRM3HTR2CCHRM2CHRM4CHRM5
SCHEMBL10655470 0.87 CHRM3 (0.58) CHRM3HTR2CCHRM2CHRM4CHRM5
SCHEMBL10653973 0.83 CHRM3 (0.58) CHRM3HTR2CCHRM2CHRM4CHRM5
SCHEMBL5533664 0.80 CHRM3 (0.45) CHRM3HTR2CSHMT2HSP90AA1CREBBP
SCHEMBL17232774 0.80 SHMT2 (0.54) SHMT2BAZ2BHSP90AA1CREBBPBRD4
SCHEMBL10458513 0.79 CHRM3 (0.52) CHRM3HTR2CCHRM2CHRM4CHRM5
SCHEMBL17229748 0.77 SHMT2 (0.42) SHMT2BAZ2BHSP90AA1CREBBPBRD4
SCHEMBL10651458 0.76 CHRM3 (0.97) CHRM3HTR2CCHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL10844051 0.75 CHRM3 (1.00) CHRM3HTR2CCHRM2CHRM4CHRM5
SCHEMBL10652885 0.74 CHRM3 (0.45) CHRM3CHRM2CHRM4CHRM5CHRM1

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-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