SCHEMBL7137397

SCHEMBL7137397

CCCN1CC[C@H](c2cccc(S(C)(=O)=O)c2)[C@H](C)C1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 12/20 0.68
SIGMAR1 Q99720 2/20 0.68
DRD3 P35462 8/20 0.67
DRD1 P21728 4/20 0.43
DRD4 P21917 4/20 0.43
DRD5 P21918 4/20 0.43
NFKB1 P19838 1/20 0.42
PRCP P42785 1/20 0.42
EBP Q15125 1/20 0.42

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
SCHEMBL7137393 1.00 DRD2 (0.68) DRD2SIGMAR1DRD3DRD1DRD4
SCHEMBL7137390 1.00 DRD2 (0.68) DRD2SIGMAR1DRD3DRD1DRD4
SCHEMBL24489427 0.87 DRD2 (0.67) DRD2SIGMAR1DRD3DRD4NFKB1
SCHEMBL17364235 0.87 DRD2 (0.67) DRD2SIGMAR1DRD3DRD4NFKB1
SCHEMBL17364173 0.87 DRD2 (0.67) DRD2SIGMAR1DRD3DRD4NFKB1
SCHEMBL21654482 0.85 DRD2 (0.64) DRD2SIGMAR1DRD3DRD1DRD4
SCHEMBL7130859 0.84 DRD2 (0.69) DRD2SIGMAR1DRD3
SCHEMBL7130854 0.84 DRD2 (0.69) DRD2SIGMAR1DRD3
SCHEMBL7130861 0.84 DRD2 (0.69) DRD2SIGMAR1DRD3
Pridopidine SCHEMBL166748 0.81 DRD2 (1.00) DRD2SIGMAR1DRD3

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
EP-1240141-B1 NEW MODULATORS OF DOPAMINE NEUROTRANSMISSION CARLSSON A RESEARCH AB (SE) 2003-11-19 EP disclosed
US-20030109532-A1 Modulators of dopamine neurotransmission A. CARLSSON RESEARCH AB (SE) 2003-06-12 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-20030109532-A1 Modulators of dopamine neurotransmission OPRD1, CHRNA5, OPRM1 DRD2 12/4885SIGMAR1 5/4885DRD3 20/4885

“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.