SCHEMBL11072709

SCHEMBL11072709

CN1C(=O)CCc2c(OCCCN3CCC(O)(c4ccccc4)CC3)cccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
SIGMAR1 Q99720 1/20 0.46
DRD2 P14416 3/20 0.46
HRH3 Q9Y5N1 1/20 0.44
HTR7 P34969 2/20 0.43
HTR1A P08908 1/20 0.42
DRD1 P21728 1/20 0.42
DRD5 P21918 1/20 0.42
SLC6A2 P23975 1/20 0.42
HTR2A P28223 1/20 0.42
SLC6A4 P31645 1/20 0.42
HRH1 P35367 1/20 0.42
DRD3 P35462 1/20 0.42
HTR2B P41595 1/20 0.42
OPRL1 P41146 1/20 0.41
ABCB1 P08183 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL11073298 0.85 ABCB1 (0.61) MEN1KMT2AALDH1A1LMNAABCB1
SCHEMBL11065111 0.84 SIGMAR1 (0.53) SIGMAR1DRD2HTR7HTR1ADRD1
SCHEMBL11070828 0.82 OPRL1 (0.47) SIGMAR1OPRL1
SCHEMBL10570155 0.81 HTR1A (0.57) SIGMAR1DRD2HRH3HTR1AHTR2A
SCHEMBL11071740 0.81 HTR7 (0.50) MEN1KMT2AALDH1A1LMNASIGMAR1
SCHEMBL11066898 0.80 DRD2 (0.53) MEN1KMT2ASIGMAR1DRD2HRH3
SCHEMBL11070967 0.78 DRD2 (0.53) MEN1KMT2AALDH1A1LMNASIGMAR1
SCHEMBL11066548 0.78 DRD4 (0.60) MEN1KMT2AALDH1A1SIGMAR1DRD2
Hydrochloric Acid SCHEMBL11063081 0.77 DRD4 (0.59) MEN1KMT2AALDH1A1SIGMAR1DRD2
SCHEMBL10572119 0.76 HTR1A (0.57) SIGMAR1DRD2HRH3HTR1ADRD1

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