SCHEMBL11070974

SCHEMBL11070974

CN1C(=O)CCc2c(OCCCN3CCC(CCCCc4ccccc4)CC3)cccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.53
CHRM2 P08172 4/20 0.50
CHRM4 P08173 4/20 0.50
CHRM5 P08912 4/20 0.50
CHRM1 P11229 4/20 0.50
CHRM3 P20309 4/20 0.50
DRD4 P21917 4/20 0.50
DRD2 P14416 3/20 0.50
DRD3 P35462 3/20 0.50
S1PR5 Q9H228 2/20 0.46
NPY1R P25929 1/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 0.44
KCNH2 Q12809 1/20 0.44
CCR3 P51677 1/20 0.44

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
SCHEMBL11066548 0.89 DRD4 (0.60) HRH3CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL11063081 0.88 DRD4 (0.59) HRH3CHRM2CHRM4CHRM5CHRM1
SCHEMBL11062798 0.83 CHRM2 (0.60) HRH3CHRM2CHRM4CHRM5CHRM1
SCHEMBL11066898 0.82 DRD2 (0.53) HRH3CHRM2CHRM4CHRM5CHRM1
SCHEMBL11063325 0.80 CHRM2 (0.53) HRH3CHRM2CHRM4CHRM5CHRM1
SCHEMBL10570155 0.78 HTR1A (0.57) HRH3CHRM2CHRM4CHRM5CHRM1
SCHEMBL11064799 0.77 TMEM97 (0.53) HRH3CHRM2CHRM4CHRM5CHRM1
SCHEMBL11063504 0.76 KCNH2 (0.50) HRH3CHRM2CHRM4CHRM5CHRM1
SCHEMBL11072709 0.75 MEN1 (0.47) HRH3DRD2DRD3MEN1KMT2A
SCHEMBL11067274 0.75 ABCB1 (0.48) DRD4DRD2MEN1KMT2AADRB2

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