SCHEMBL6412100

SCHEMBL6412100

Cc1c(C(=O)N(C(C)C)[C@@H]2CCNC2)ccc(Cl)c1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 20/20 1.00
SLC6A2 P23975 19/20 1.00
SLC6A3 Q01959 14/20 0.57
KCNH2 Q12809 7/20 0.57
OPRK1 P41145 1/20 0.52
CYP2D6 P10635 2/20 0.51
CYP3A4 P08684 1/20 0.47

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
Hydrochloric Acid SCHEMBL6414927 0.99 SLC6A4 (0.98) SLC6A4SLC6A2SLC6A3KCNH2OPRK1
SCHEMBL4634498 0.82 SLC6A4 (0.78) SLC6A4SLC6A2SLC6A3KCNH2OPRK1
SCHEMBL4634030 0.79 SLC6A4 (0.74) SLC6A4SLC6A2SLC6A3KCNH2OPRK1
SCHEMBL4634712 0.78 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3KCNH2OPRK1
SCHEMBL4634250 0.76 SLC6A4 (0.67) SLC6A4SLC6A2SLC6A3KCNH2CYP2D6
SCHEMBL4634890 0.74 SLC6A4 (0.77) SLC6A4SLC6A2SLC6A3KCNH2OPRK1
SCHEMBL4634516 0.74 SLC6A2 (0.82) SLC6A4SLC6A2SLC6A3KCNH2OPRK1
SCHEMBL4634194 0.74 SLC6A4 (0.71) SLC6A4SLC6A2SLC6A3KCNH2OPRK1
SCHEMBL4634825 0.74 SLC6A2 (0.81) SLC6A4SLC6A2SLC6A3KCNH2OPRK1
SCHEMBL4634072 0.73 SLC6A2 (1.00) SLC6A4SLC6A2SLC6A3KCNH2OPRK1

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-20050014789-A1 Amide derivatives as selective serotonin re-uptake inhibitors PFIZER INC 2005-01-20 US claimed
US-20050014789-A1 Amide derivatives as selective serotonin re-uptake inhibitors PFIZER 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-20050014789-A1 Amide derivatives as selective serotonin re-uptake inhibitors SLC6A4, HTR3C, HTR3A SLC6A4 1/4885SLC6A2 7/4885SLC6A3 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.