SCHEMBL24312699

SCHEMBL24312699

CC(C)C1CN(C(=O)C2CNC2)C1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 20/20 0.48
CHRNA3 P32297 20/20 0.48
CHRNA4 P43681 20/20 0.48
CHRNB4 P30926 18/20 0.48
CHRNA7 P36544 17/20 0.48
CHRNB3 Q05901 2/20 0.37
CHRNA6 Q15825 2/20 0.37

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
SCHEMBL10119970 0.82 CHRNB2 (0.50) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL14147670 0.81 CHRNB2 (0.44) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL25480236 0.80 CHRNB2 (0.39) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL24671074 0.78 CHRNB2 (0.38) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL19111278 0.78 CHRNB2 (0.53) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL25480245 0.77 HRH3 (0.44) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL19735106 0.77 PIK3CD (0.37) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL24312704 0.77 CHRNB2 (0.44) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL25581281 0.76 CHRNB2 (0.44) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL25513855 0.74 HRH3 (0.36) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7

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-2022074459-A2 AUTOTAXIN INHIBITOR COMPOUNDS ILDONG PHARMACEUTICAL CO., LTD. (KR) 2022-04-14 WO disclosed