SCHEMBL6792848

SCHEMBL6792848

CN1C2CCC1C(C(N)=O)[C@@H](c1ccccc1)C2

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.72
SLC6A2 P23975 5/20 0.72
SLC6A4 P31645 5/20 0.72

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
SCHEMBL7088802 0.89 SLC6A3 (0.76) SLC6A3SLC6A2SLC6A4
SCHEMBL7669406 0.89 SLC6A3 (0.76) SLC6A3SLC6A2SLC6A4
SCHEMBL15516162 0.89 SLC6A3 (0.76) SLC6A3SLC6A2SLC6A4
SCHEMBL4996780 0.88 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL4996786 0.88 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL9405547 0.87 SLC6A3 (0.74) SLC6A3SLC6A2SLC6A4
SCHEMBL9405548 0.87 SLC6A3 (0.74) SLC6A3SLC6A2SLC6A4
SCHEMBL9405598 0.87 SLC6A3 (0.74) SLC6A3SLC6A2SLC6A4
SCHEMBL15630452 0.86 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL8940225 0.86 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6706880-B2 USED AS IMAGING OR PHARMACEUTICAL AGENTS, IN THE DIAGNOSIS AND THERAPY OF DRUG ADDICTION, DEPRESSION, ANOREXIA AND NEURODEGENERATIVE DISEASES RESEARCH TRIANGLE INSTITUTE 2004-03-16 US disclosed
US-20030023090-A1 Cocaine receptor binding ligands RESEARCH TRIANGLE INSTITUTE 2003-01-30 US disclosed
EP-1079833-A4 COCAINE RECEPTOR BINDING LIGANDS RES TRIANGLE INST (US) 2002-12-18 EP disclosed
US-6329520-B1 USED AS IMAGING OR PHARMACEUTICAL AGENTS, IN THE DIAGNOSIS AND TREATMENT OF DRUG ADDICTION, DEPRESSION, ANOREXIA AND NEURODEGENERATIVE DISEASES OR IN DETERMINING DOSES OF THERAPEUTIC AGENTS THAT OCCUPY MANY RECEPTORS RESEARCH TRIANGLE INSTITUTE 2001-12-11 US disclosed
EP-1079833-A1 COCAINE RECEPTOR BINDING LIGANDS RESEARCH TRIANGLE INSTITUTE (US) 2001-03-07 EP disclosed
WO-1999061023-A1 COCAINE RECEPTOR BINDING LIGANDS RESEARCH TRIANGLE INSTITUTE (US) 1999-12-02 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-20030023090-A1 Cocaine receptor binding ligands OPRL1, SLC18A2, SLC6A3 SLC6A3 3/4885SLC6A2 6/4885SLC6A4 5/4885

“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.