SCHEMBL11068538

SCHEMBL11068538

C#CCN1C(=O)CCc2ccc(OCCCN3CCC(c4ccccc4)CC3)cc21

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.57
CHRM4 P08173 1/20 0.57
CHRM5 P08912 1/20 0.57
CHRM1 P11229 1/20 0.57
DRD2 P14416 1/20 0.57
CHRM3 P20309 1/20 0.57
DRD4 P21917 1/20 0.57
DRD3 P35462 1/20 0.57
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52

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
SCHEMBL11068257 0.88 ADRB2 (0.59) CHRM2CHRM4CHRM5CHRM1DRD2
SCHEMBL11071029 0.87 CHRM2 (0.59) CHRM2CHRM4CHRM5CHRM1DRD2
SCHEMBL11068723 0.85 CHRM1 (0.63) CHRM2CHRM4CHRM5CHRM1DRD2
SCHEMBL10568168 0.85 DRD2 (0.56) CHRM2CHRM4CHRM5CHRM1DRD2
SCHEMBL11064740 0.85 PRMT5 (0.47) CHRM2CHRM4CHRM5CHRM1DRD2
SCHEMBL11067478 0.85 CHRM2 (0.58) CHRM2CHRM4CHRM5CHRM1DRD2
SCHEMBL11095714 0.85 CHRM1 (0.62) CHRM2CHRM4CHRM5CHRM1DRD2
Oxalic Acid SCHEMBL11060359 0.82 CHRM1 (0.59) CHRM2CHRM4CHRM5CHRM1DRD2
Oxalic Acid SCHEMBL11069052 0.82 CHRM1 (0.58) CHRM2CHRM4CHRM5CHRM1DRD2
SCHEMBL10570344 0.80 DRD2 (0.63) DRD2DRD4DRD3

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-4482560-A Carbostyril derivatives, and antihistaminic agents containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-13 US disclosed