SCHEMBL805484

SCHEMBL805484

CCN1CCc2cccc(Cl)c2C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.42
CYP2D6 P10635 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
DRD1 P21728 4/20 0.42
DRD3 P35462 3/20 0.42
DRD2 P14416 2/20 0.42
NPSR1 Q6W5P4 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
NOTUM Q6P988 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
P2RX7 Q99572 1/20 0.39
HTT P42858 1/20 0.39
PNMT P11086 1/20 0.38

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
SCHEMBL805487 0.84 PARP1 (0.47) NPSR1HTR2AHTR2CHTR2BP2RX7
SCHEMBL15621624 0.79 ADRA2A (0.50) ADRA2ACYP2D6ADRA2BADRA2CADRA1D
SCHEMBL22193281 0.77 NOTUM (0.53) ADRA2ACYP2D6ADRA2BADRA2CADRA1D
SCHEMBL803068 0.75 CYP2D6 (0.42) ADRA2ACYP2D6ADRA2BADRA2CADRA1D
SCHEMBL4095444 0.74 ALK (0.39)
SCHEMBL15830836 0.74 EZH2 (0.68)
SCHEMBL29500340 0.74 HRH3 (0.44)
SCHEMBL179076 0.73 HTT (0.51) CYP2D6DRD1DRD3DRD2HTT
SCHEMBL29438739 0.73 HTT (0.51) CYP2D6DRD1DRD3DRD2HTT
SCHEMBL29160835 0.73 ADRA2A (0.51) ADRA2ACYP2D6ADRA2BADRA2CADRA1D

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-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US 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-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 ADRA2A 89/4885CYP2D6 900/4885ADRA2B 45/4885

“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.