SCHEMBL25082064

SCHEMBL25082064

CC(C)OC(=O)CC1CN2CCC1CC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 5/20 0.41
▸ CHRM1 P11229 4/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.36
▸ MIF P14174 1/20 0.35
▸ CHRM3 P20309 3/20 0.35
▸ CHRNA7 P36544 2/20 0.34
▸ CHRNA4 P43681 2/20 0.34
▸ HTR3A P46098 2/20 0.34
▸ CHRNB2 P17787 1/20 0.34
▸ CHRNB4 P30926 1/20 0.34
▸ CHRNA3 P32297 1/20 0.34
▸ EGFR P00533 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ MAPT P10636 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
SCHEMBL12614403 0.83 CHRM2 (0.43) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL7319174 0.80 CHRM2 (0.41) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL23435952 0.80 CHRM2 (0.41) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL23315373 0.80 CHRM2 (0.41) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL12413666 0.79 CHRM2 (0.40) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL12506844 0.77 CHRM2 (0.47) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL9698309 0.75 CHRM2 (0.37) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL13658288 0.75 CHRM3 (0.41) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL9697942 0.75 CHRM1 (0.45) CHRM2CHRM1CYP2D6MEN1KMT2A
SCHEMBL21063808 0.74 CHRNA7 (0.41) CHRM2CHRM1CYP2D6MEN1KMT2A

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
WO-2023021149-A1 PRODRUGS FOR USE IN THE TREATMENT OF TISSUE DAMAGE UCL BUSINESS LTD (GB) 2023-02-23 — — WO disclosed
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