SCHEMBL7079939

SCHEMBL7079939

CN1CC[C@@H](c2ccc(Cl)cc2)[C@H](C=O)C1

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 1/20 0.56

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
SCHEMBL7079941 1.00 SLC6A3 (0.56) SLC6A3
SCHEMBL7800963 1.00 SLC6A3 (0.56) SLC6A3
SCHEMBL7079936 1.00 SLC6A3 (0.56) SLC6A3
SCHEMBL13979388 0.86 SLC6A2 (0.41) SLC6A3
SCHEMBL13594763 0.85 — —
SCHEMBL14224128 0.84 SLC6A2 (0.54) SLC6A3
SCHEMBL7094658 0.84 SLC6A2 (0.58) SLC6A3
SCHEMBL6042661 0.76 SLC6A3 (0.60) SLC6A3
SCHEMBL13979122 0.75 — —
SCHEMBL2636786 0.75 — —

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-6605621-B1 Safe and effective detoxification after treating drug addiction, or diseases wherein cocaine is administered GEORGETOWN UNIVERSITY 2003-08-12 — — US disclosed
US-20030144289-A1 Monomeric and dimeric heterocycles, and therapeutic uses thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-07-31 — — US disclosed
US-6440996-B1 Monomeric and dimeric heterocycles, and therapeutic uses thereof GEORGETOWN UNIVERSITY 2002-08-27 — — 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-20030144289-A1 Monomeric and dimeric heterocycles, and therapeutic uses thereof HAX1, MLX, XDH SLC6A3 85/4885

“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.

Send feedback