SCHEMBL4428209

SCHEMBL4428209

Clc1ccc(SC2CCN(c3nc4ccccc4[nH]3)CC2)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPC3 Q13507 2/20 0.55
BCHE P06276 2/20 0.50
ACHE P22303 2/20 0.50
HTR3A P46098 1/20 0.49
MAPT P10636 4/20 0.48
TP53 P04637 3/20 0.48
LMNA P02545 2/20 0.47
RAB9A P51151 1/20 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
SCHEMBL4434921 0.78 TRPC3 (0.56) TRPC3BCHEACHEHTR3AMAPT
SCHEMBL4433260 0.77 TRPC3 (0.55) TRPC3BCHEACHEHTR3AMAPT
SCHEMBL22481379 0.73 TRPC3 (0.75) TRPC3BCHEACHEHTR3AMAPT
SCHEMBL13450331 0.72 TRPC3 (1.00) TRPC3BCHEACHEHTR3AMAPT
SCHEMBL7848240 0.72 TRPC3 (0.73) TRPC3BCHEACHEHTR3AMAPT
SCHEMBL2676103 0.70 BCHE (0.96) TRPC3BCHEACHEHTR3AMAPT
SCHEMBL2674037 0.70 BCHE (0.90) TRPC3BCHEACHEHTR3AMAPT
SCHEMBL9369695 0.69 TRPC3 (0.68) TRPC3BCHEACHEHTR3AMAPT
SCHEMBL4713162 0.69 TRPC3 (0.68) TRPC3BCHEACHEHTR3AMAPT
SCHEMBL717865 0.68 BCHE (1.00) TRPC3BCHEACHEHTR3AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090239880-A1 COMBINATIONS OF MONOAMINE REUPTAKE INHIBITORS AND POTASSIUM CHANNEL ACTIVATORS NEUROSEARCH A/S (DK) 2009-09-24 US claimed
US-20090239880-A1 COMBINATIONS OF MONOAMINE REUPTAKE INHIBITORS AND POTASSIUM CHANNEL ACTIVATORS NEUROSEARCH A/S (DK) 2009-09-24 US disclosed
EP-2043641-A2 COMBINATIONS OF MONOAMINE REUPTAKE INHIBITORS AND POTASSIUM CHANNEL ACTIVATORS NeuroSearch A/S (DK) 2009-04-08 EP disclosed
WO-2008003667-A2 COMBINATIONS OF MONOAMINE REUPTAKE INHIBITORS AND POTASSIUM CHANNEL ACTIVATORS NEUROSEARCH A/S (DK) 2008-01-10 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-20090239880-A1 COMBINATIONS OF MONOAMINE REUPTAKE INHIBITORS AND POTASSIUM CHANNEL ACTIVATORS SLC6A2, SLC18A2, SLC6A4 TRPC3 232/4885BCHE 1229/4885ACHE 387/4885

“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.