SCHEMBL11065083

SCHEMBL11065083

O=C1CCc2c(cccc2OCCCCN2CCC(Cc3ccccc3)CC2)N1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.65
MAOB P27338 2/20 0.65
DRD4 P21917 1/20 0.56
KDM4E B2RXH2 4/20 0.56
ALDH1A1 P00352 2/20 0.56
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
SIGMAR1 Q99720 3/20 0.52
TMEM97 Q5BJF2 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CCR3 P51677 1/20 0.49
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
HRH3 Q9Y5N1 1/20 0.48
KCNH2 Q12809 1/20 0.47

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
SCHEMBL11065044 0.97 MAOA (0.61) MAOAMAOBDRD4KDM4EALDH1A1
Hydrochloric Acid SCHEMBL11067443 0.96 MAOA (0.60) MAOAMAOBDRD4KDM4EALDH1A1
SCHEMBL11073307 0.94 MAOA (0.57) MAOAMAOBDRD4KDM4EALDH1A1
SCHEMBL11070939 0.88 MAOA (0.52) MAOAMAOBDRD4KDM4EALDH1A1
SCHEMBL11063504 0.87 KCNH2 (0.50) MAOAMAOBDRD4MEN1KMT2A
SCHEMBL11073435 0.83 HTR7 (0.48) MAOAMAOBDRD4MEN1KMT2A
SCHEMBL10576436 0.83 MAOA (0.63) MAOAMAOBDRD4KDM4EALDH1A1
Hydrochloric Acid SCHEMBL11070539 0.82 HTR7 (0.47) MAOAMAOBDRD4SIGMAR1HRH3
SCHEMBL11072939 0.82 DRD4 (0.62) DRD4MEN1KMT2A
SCHEMBL11071304 0.82 DRD4 (0.62) MAOAMAOBDRD4MEN1KMT2A

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