SCHEMBL6667511

SCHEMBL6667511

COc1ccccc1NC(=O)OCC1CCNCC1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CHRM3 P20309 17/20 0.67
▸ CHRM2 P08172 12/20 0.67
▸ CHRM1 P11229 12/20 0.67
▸ KMT2A Q03164 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ HDAC1 Q13547 1/20 0.54
▸ HDAC2 Q92769 1/20 0.54

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
SCHEMBL6668796 0.93 CHRM3 (0.68) CHRM3CHRM2CHRM1KMT2AL3MBTL1
SCHEMBL6663170 0.85 CHRM3 (0.67) CHRM3CHRM2CHRM1HDAC1HDAC2
SCHEMBL6664439 0.82 CHRM3 (0.56) CHRM3KMT2AL3MBTL1
SCHEMBL5225659 0.82 CHRM3 (0.60) CHRM3CHRM2CHRM1KMT2AHDAC1
SCHEMBL6665160 0.80 TDP1 (0.63) KMT2AL3MBTL1HDAC1HDAC2
SCHEMBL6664326 0.80 MAPT (0.60) HDAC1HDAC2
SCHEMBL6666206 0.79 CHRM3 (0.53) CHRM3KMT2AL3MBTL1
SCHEMBL6663459 0.79 CHRM3 (0.58) CHRM3KMT2AL3MBTL1
SCHEMBL17205165 0.78 TGFBR1 (0.57) CHRM3KMT2AL3MBTL1
SCHEMBL6664925 0.78 KMT2A (0.56) CHRM3KMT2AL3MBTL1

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-2004014425-A1 ACTIVATORS OF SMALL CONDUCTANCE CALCIUM ACTIVATED POTASSIUM CHANNELS AND USE THEREOF GLAXO GROUP LIMITED (GB) 2004-02-19 — — WO disclosed
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