SCHEMBL6154073

SCHEMBL6154073

COc1cc(NC2CCN(Cc3ccccc3)CC2)c(C)cc1C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 8/20 0.58
DRD2 P14416 4/20 0.58
DRD3 P35462 3/20 0.58
CYP3A4 P08684 2/20 0.56
CYP1A2 P05177 1/20 0.56
ADRA2A P08913 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
ADRA2B P18089 1/20 0.56
ADRA2C P18825 1/20 0.56
ACHE P22303 1/20 0.56
SLC6A2 P23975 1/20 0.56
HTR2A P28223 1/20 0.56
HTR2C P28335 1/20 0.56
ADRA1A P35348 1/20 0.56
OPRK1 P41145 1/20 0.56
HTR2B P41595 1/20 0.56
CHRNA4 P43681 1/20 0.56
HTR3A P46098 1/20 0.56
SLC6A3 Q01959 1/20 0.56

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
SCHEMBL6156084 0.90 DRD4 (0.68) DRD4DRD2DRD3CYP3A4CYP1A2
Hydrochloric Acid SCHEMBL6154218 0.89 DRD4 (0.67) DRD4DRD2DRD3CYP3A4CYP1A2
SCHEMBL6153691 0.84 MCHR1 (0.60) DRD4DRD2DRD3CYP3A4CYP1A2
SCHEMBL6153565 0.82 SIGMAR1 (0.59) DRD4DRD2DRD3CYP3A4CYP1A2
SCHEMBL6154970 0.80 MCHR1 (0.56) DRD4DRD2DRD3CYP3A4CYP1A2
SCHEMBL6154012 0.80 OPRK1 (0.55) DRD4CYP3A4CYP1A2CYP2D6CYP2C9
SCHEMBL12341150 0.80 CDK2 (0.44)
SCHEMBL6154441 0.80 ACHE (0.57) DRD4DRD2DRD3ACHESIGMAR1
SCHEMBL444689 0.79 KDM4E (0.62) DRD4DRD2DRD3KCNH2SIGMAR1
SCHEMBL12342305 0.79 ALDH1A1 (0.47) CYP3A4CYP2C9PDE4D

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 DRD4 3929/4885DRD2 3058/4885DRD3 3072/4885

“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.