SCHEMBL13630498

SCHEMBL13630498

COc1ccc(Cl)c(N2CCN(CCC3CCN(CC(C)=O)CC3)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
MCL1 Q07820 1/20 0.52
FFAR4 Q5NUL3 1/20 0.51
ALDH1A1 P00352 2/20 0.48
GAA P10253 1/20 0.48
DRD2 P14416 8/20 0.47
DRD3 P35462 8/20 0.47
DRD4 P21917 4/20 0.45
HTR1A P08908 4/20 0.44
HTR2A P28223 3/20 0.44
HTR2C P28335 3/20 0.44
HTR2B P41595 3/20 0.44
DRD1 P21728 2/20 0.44
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC6A4 P31645 1/20 0.43

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
SCHEMBL3853871 0.89 POLB (0.48) USP2LMNAMAPTHTTMCL1
SCHEMBL3849149 0.89 DRD2 (0.49) MAPTHTTALDH1A1DRD2DRD3
SCHEMBL3846460 0.87 ADRA1B (0.50) DRD2DRD3HTR1ASLC6A4
SCHEMBL3845719 0.86 FFAR4 (0.48) USP2LMNAMAPTHTTMCL1
SCHEMBL3853707 0.84 DRD2 (0.48) DRD2DRD3DRD4HTR1AHTR2A
SCHEMBL3845174 0.84 DRD2 (0.59) DRD2DRD3DRD4HTR1AHTR2A
SCHEMBL3843688 0.84 ADRA1B (0.49) USP2ALDH1A1DRD2DRD3
SCHEMBL17226446 0.83 USP2 (0.50) USP2LMNAMAPTHTTMCL1
SCHEMBL3844066 0.82 DRD2 (0.59) MAPTALDH1A1DRD2DRD3DRD4
SCHEMBL3854012 0.82 DRD2 (0.57) DRD2DRD3DRD4HTR1AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286801-A1 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2009-11-19 US disclosed
US-20090286801-A1 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2009-11-19 US disclosed
WO-2007148208-A2 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2007-12-27 WO 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-20090286801-A1 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS DRD3, TACR2, TACR1 USP2 2684/4885LMNA 4869/4885MAPT 2805/4885

“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.