SCHEMBL8060480

SCHEMBL8060480

CC(C)(C)OC1CCN(Cc2ccccc2)C(N=C=O)C1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.39
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
SIGMAR1 Q99720 2/20 0.33
HTR1A P08908 2/20 0.33
HRH3 Q9Y5N1 1/20 0.33
ACHE P22303 1/20 0.33
BCHE P06276 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL10361894 0.85 GBA1 (0.40) GBA1SIGMAR1HTR1AHRH3ACHE
SCHEMBL17274419 0.73 OPRD1 (0.43) GBA1
SCHEMBL7394512 0.73 SIGMAR1 (0.35) GBA1SIGMAR1ACHEBCHE
SCHEMBL9688491 0.71 ACHE (0.60) KMT2ASIGMAR1HRH3ACHEBCHE
SCHEMBL9653602 0.71 HTR2B (0.42) GBA1JAK2JAK1SIGMAR1
SCHEMBL3941806 0.69 ACHE (0.53) KMT2ASIGMAR1HRH3ACHEBCHE
SCHEMBL3941803 0.69 ACHE (0.53) KMT2ASIGMAR1HRH3ACHEBCHE
SCHEMBL3943931 0.69 ACHE (0.53) KMT2ASIGMAR1HRH3ACHEBCHE
SCHEMBL27486053 0.68 GBA1 (0.40) GBA1CHRM2CHRM4CHRM5CHRM1
SCHEMBL3457361 0.67 CHRM2 (0.43) GBA1CHRM2CHRM4CHRM5CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6140333-A FOR TREATMENT AND/OR PROPHYLAXIS OF DISEASES INCLUDE SUCH RESPIRATORY DISEASES AS CHRONIC OBSTRUCTIVE PULMONARY DISEASES, CHRONIC BRONCHITIS, ASTHMA, CHRONIC RESPIRATORY OBSTRUCTION, PULMONARY FIBROSIS, PULMONARY EMPHYSEMA BANYU PHARMACEUTICAL CO LTD (JP) 2000-10-31 US disclosed