SCHEMBL20209966

SCHEMBL20209966

CNC(=O)C1(c2ccc(Cl)c(Cl)c2)CCC(C)CCC1CO

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 16/20 0.49
SLC6A4 P31645 15/20 0.49
CCR2 P41597 2/20 0.37
SLC6A2 P23975 2/20 0.37

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
SCHEMBL14889504 0.87 SLC6A3 (0.61) SLC6A3SLC6A4SLC6A2
SCHEMBL16474237 0.87 SLC6A3 (0.61) SLC6A3SLC6A4SLC6A2
SCHEMBL2471888 0.86 SLC6A3 (0.62) SLC6A3SLC6A4SLC6A2
SCHEMBL19749354 0.81 SLC6A3 (0.42) SLC6A3SLC6A4CCR2SLC6A2
SCHEMBL20209823 0.78 SLC6A4 (0.76) SLC6A3SLC6A4SLC6A2
SCHEMBL13273210 0.75 SLC6A4 (0.59) SLC6A3SLC6A4SLC6A2
SCHEMBL20209815 0.75 SLC6A4 (0.59) SLC6A3SLC6A4SLC6A2
SCHEMBL3516287 0.72 SLC6A3 (0.68) SLC6A3SLC6A4SLC6A2
SCHEMBL3520671 0.72 SLC6A3 (0.68) SLC6A3SLC6A4SLC6A2
SCHEMBL3520667 0.72 SLC6A3 (0.68) SLC6A3SLC6A4SLC6A2

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
US-10428021-B2 Triple reuptake inhibitors and methods of their use SUNOVION PHARMACEUTICALS INC. (US) 2019-10-01 US disclosed
US-20180148407-A1 TRIPLE REUPTAKE INHIBITORS AND METHODS OF THEIR USE SUNOVION PHARMACEUTICALS INC. 2018-05-31 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 (2 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-10428021-B2 Triple reuptake inhibitors and methods of their use SLC18A2, SLC6A2, SLC18A3 SLC6A3 5/4885SLC6A4 4/4885CCR2 4358/4885
US-20180148407-A1 TRIPLE REUPTAKE INHIBITORS AND METHODS OF THEIR USE SLC18A2, SLC6A2, SLC18A3 SLC6A3 5/4885SLC6A4 4/4885CCR2 4358/4885

“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.