SCHEMBL7206520

SCHEMBL7206520

CN(Cc1cc(Br)ccc1Oc1ccc2c(c1)CCS2)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 6/20 0.56
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
POLB P06746 1/20 0.38
KMT2A Q03164 6/20 0.38
MEN1 O00255 5/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RYR2 Q92736 1/20 0.36
ALOX5 P09917 1/20 0.36
HTR2A P28223 1/20 0.35
KCNH2 Q12809 1/20 0.35
LMNA P02545 2/20 0.35
CCR5 P51681 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL7213331 0.86 SLC6A4 (0.54) SLC6A4SLC6A2SLC6A3KMT2AMEN1
SCHEMBL7206556 0.79 SLC6A4 (0.58) SLC6A4HTR2AKCNH2
SCHEMBL7213362 0.77 SLC6A4 (0.51) SLC6A4SLC6A2KMT2AMEN1RYR2
SCHEMBL7207167 0.73 SLC6A4 (0.69) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL7129893 0.73 SLC6A4 (0.45) SLC6A4KMT2AALDH1A1GAANPSR1
SCHEMBL7065053 0.72 SLC6A4 (0.69) SLC6A4SLC6A2SLC6A3
SCHEMBL6151948 0.70 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3POLBKMT2A
SCHEMBL5878711 0.70 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL7066474 0.69 SLC6A4 (0.62) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL7130346 0.69 SLC6A4 (0.52) SLC6A4SLC6A2SLC6A3HTR2AKCNH2

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-6610747-B2 Such as 4-(2,3-dihydro-1-benzothien-5-yloxy)-3-((methylamino) methyl)-benzenesulfonamide for use as serotonin re-uptake inhibitors (SSRIs) in treatment of depression, attention deficit hyperactivity disorder, obsessive-compulsive disorder PFIZER INC. 2003-08-26 US disclosed
US-20030060456-A1 Such as 4-(2,3-dihydro-1-benzothien-5-yloxy)-3-((methylamino) methyl)-benzenesulfonamide for use as serotonin re-uptake inhibitors (SSRIs) in treatment of depression, attention deficit hyperactivity disorder, obsessive-compulsive disorder PFIZER INC. 2003-03-27 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-20030060456-A1 Such as 4-(2,3-dihydro-1-benzothien-5-yloxy)-3-((methylamino) methyl)-benzenesulfonamide for use as serotonin re-uptake inhibitors (SSRIs) in treatment of depression, attention deficit hyperactivity disorder, obsessive-compulsive disorder HTR6, HTR2C, SLC6A3 SLC6A4 5/4885SLC6A2 9/4885SLC6A3 3/4885

“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.