SCHEMBL6411776

SCHEMBL6411776

CN1C(=O)N(c2ccccc2)CCC1CN1CCC(Cc2cc(Cl)ccc2Br)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 15/20 0.44
HTR1A P08908 13/20 0.44
SLC6A2 P23975 2/20 0.40
DRD2 P14416 2/20 0.38
DRD3 P35462 2/20 0.38
KCNH2 Q12809 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 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
SCHEMBL6418287 0.93 SLC6A4 (0.44) SLC6A4HTR1ASLC6A2DRD2DRD3
SCHEMBL6420020 0.90 SLC6A4 (0.44) SLC6A4HTR1ASLC6A2DRD2DRD3
SCHEMBL6410636 0.89 SLC6A4 (0.46) SLC6A4HTR1A
SCHEMBL6414636 0.87 HTR1A (0.60) SLC6A4HTR1AMEN1KMT2A
SCHEMBL6419396 0.86 SLC6A4 (0.47) SLC6A4HTR1ASLC6A2
SCHEMBL6414080 0.85 HTR1A (0.49) SLC6A4HTR1ADRD2DRD3KCNH2
SCHEMBL6411061 0.85 HTR1A (0.48) SLC6A4HTR1A
SCHEMBL6614469 0.85 SLC6A4 (0.42) SLC6A4HTR1ASLC6A2NOS3NOS1
SCHEMBL6418595 0.83 SLC6A4 (0.44) SLC6A4HTR1ASLC6A2DRD2DRD3
SCHEMBL6414869 0.82 SLC6A4 (0.47) SLC6A4HTR1ASLC6A2

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-20050065140-A1 Serotonine reuptake inhibitor SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2005-03-24 US disclosed
EP-1466901-A1 SEROTONINE REUPTAKE INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-10-13 EP 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-20050065140-A1 Serotonine reuptake inhibitor HTR1A, SLC6A4, SLC6A2 SLC6A4 2/4885HTR1A 1/4885SLC6A2 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.