SCHEMBL11064023

SCHEMBL11064023

O=C1CCc2cccc(OCCCN3CCC(c4ccccc4)CC3)c2N1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.51
CHRM2 P08172 1/20 0.51
CHRM4 P08173 1/20 0.51
CHRM5 P08912 1/20 0.51
CHRM1 P11229 1/20 0.51
CHRM3 P20309 1/20 0.51
DRD4 P21917 1/20 0.51
DRD3 P35462 1/20 0.51
HTR7 P34969 2/20 0.48
SIGMAR1 Q99720 7/20 0.45
MAOA P21397 4/20 0.44
MAOB P27338 4/20 0.44
MEN1 O00255 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 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
SCHEMBL11071039 0.88 DRD2 (0.53) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11071104 0.86 MAOA (0.61) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL11073435 0.83 HTR7 (0.48) DRD2CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL11070539 0.82 HTR7 (0.47) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL11066899 0.80 HTR7 (0.50) DRD2DRD4DRD3HTR7SIGMAR1
SCHEMBL10569528 0.80 KCNA5 (0.50) DRD2DRD4DRD3SIGMAR1MAOA
SCHEMBL10572638 0.79 DRD2 (0.63) DRD2DRD4DRD3MAOAMAOB
SCHEMBL22022834 0.79 KDM1A (0.69)
SCHEMBL11062872 0.78 KDM1A (0.66) DRD2DRD4DRD3HTR7MAOA
SCHEMBL11066640 0.78 MAOA (0.71) DRD2MAOAMAOB

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