SCHEMBL6156880

SCHEMBL6156880

COc1cc(N(C)C2CCN(Cc3ccccc3)CC2)ccc1C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.54
CHRM3 P20309 2/20 0.54
SLC2A1 P11166 1/20 0.54
DRD2 P14416 4/20 0.50
DRD4 P21917 4/20 0.50
ACHE P22303 3/20 0.50
OPRM1 P35372 3/20 0.50
OPRK1 P41145 2/20 0.50
OPRD1 P41143 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
ADRA2A P08913 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
ADRA2B P18089 1/20 0.50
ADRA2C P18825 1/20 0.50
SLC6A2 P23975 1/20 0.50
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50
ADRA1A P35348 1/20 0.50

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
SCHEMBL6155353 0.82 PARP15 (0.43) CHRM3CYP1A2CYP3A4HTR2AHTR2C
SCHEMBL6153941 0.80 OPRM1 (0.68) CHRM2CHRM3OPRM1OPRK1OPRD1
SCHEMBL6153691 0.78 MCHR1 (0.60) DRD2DRD4ACHEOPRK1CYP1A2
SCHEMBL9785706 0.78 CHRM2 (0.67) CHRM2CHRM3ACHEOPRM1KDM4E
SCHEMBL11177526 0.78 DRD4 (0.55) CHRM2CHRM3SLC2A1DRD2DRD4
SCHEMBL6153634 0.77 PARP15 (0.44) CYP1A2CYP3A4SLC6A2L3MBTL1ALDH1A1
SCHEMBL11188797 0.76 DRD4 (0.58) CHRM2CHRM3SLC2A1DRD2DRD4
SCHEMBL6154970 0.75 MCHR1 (0.56) DRD2DRD4ACHEOPRK1CYP1A2
SCHEMBL21375648 0.74 SIGMAR1 (0.60) CHRM2CHRM3DRD2DRD4ACHE
SCHEMBL6140723 0.74 GAA (0.50) ACHEKDM4EL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 CHRM2 833/4885CHRM3 1132/4885SLC2A1 134/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.