SCHEMBL5633162

SCHEMBL5633162

CNC(C1CCNC1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.48
SLC6A4 P31645 20/20 0.48
SLC6A3 Q01959 20/20 0.48
CYP2D6 P10635 4/20 0.44

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
SCHEMBL7138678 0.77 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5633421 0.76 LMNA (0.43) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5633714 0.76 LMNA (0.45) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL28296797 0.75 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL11771618 0.74 SLC6A2 (0.53) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL20217195 0.73 SMYD3 (0.49)
SCHEMBL27653826 0.73 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5634494 0.72 OPRD1 (0.40) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL4923835 0.72 TAAR1 (0.43) SLC6A2SLC6A4SLC6A3
SCHEMBL6641573 0.71 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3CYP2D6

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-7244758-B2 N-type calcium channel blockers NEUROMED PHARMACEUTICALS LTD. (CA) 2007-07-17 US disclosed
CN-1816332-A 3-aminomethyl-pyrrolidines as N-type calcium channel blockers NEUROMED TECH INC (CA) 2006-08-09 CN disclosed
US-20050014748-A1 N-type calcium channel blockers NEUROMED TECHNOLOGIES INC. 2005-01-20 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-20050014748-A1 N-type calcium channel blockers CACNA1B, CACNA1C, CACNA1I SLC6A2 723/4885SLC6A4 332/4885SLC6A3 730/4885

“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.