SCHEMBL24434890

SCHEMBL24434890

CC(C)N1CCC(c2cccc(-c3cccc(C4CCCN(C(C)C)C4)c3)c2)CC1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.63
DRD3 P35462 6/20 0.63
VCP P55072 1/20 0.45
PARP1 P09874 1/20 0.42
PARP2 Q9UGN5 1/20 0.42
KCNH2 Q12809 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
DRD1 P21728 2/20 0.41
DRD4 P21917 2/20 0.41
DRD5 P21918 2/20 0.41
NFKB1 P19838 1/20 0.40
PRCP P42785 1/20 0.40
EBP Q15125 1/20 0.40
SIGMAR1 Q99720 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
SCHEMBL7323009 0.81 DRD3 (0.66) DRD2DRD3DRD1DRD4DRD5
SCHEMBL2603312 0.79 KCNH2 (0.61) DRD2DRD3KCNH2HRH3DRD1
SCHEMBL21323287 0.79 DRD2 (0.63) DRD2DRD3PARP1PARP2KCNH2
SCHEMBL17658922 0.79 DRD2 (0.63) DRD2DRD3PARP1PARP2KCNH2
SCHEMBL2603277 0.79 DRD2 (0.63) DRD2DRD3PARP1PARP2KCNH2
SCHEMBL24434619 0.78 DRD2 (0.54) DRD2DRD3KCNH2HRH3DRD1
SCHEMBL23102153 0.78 DRD2 (0.63) DRD2DRD3KCNH2
SCHEMBL7349109 0.77 DRD3 (1.00) DRD2DRD3DRD1DRD4DRD5
SCHEMBL11400486 0.77 DRD3 (0.62) DRD2DRD3
SCHEMBL22795471 0.77 DRD2 (0.54) DRD2DRD3PARP1PARP2KCNH2

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-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 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-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G DRD2 4602/4885DRD3 4250/4885VCP 30/4885

“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.