SCHEMBL6412307

SCHEMBL6412307

CCNC(=O)NC1CCC(CCN2CCC(Cc3cc(OC)ccc3Br)CC2)CC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 19/20 0.56
SLC6A4 P31645 18/20 0.56
DRD2 P14416 1/20 0.45
HTR2A P28223 1/20 0.45

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
SCHEMBL6412310 1.00 HTR1A (0.56) HTR1ASLC6A4DRD2HTR2A
SCHEMBL6410059 0.95 SLC6A4 (0.54) HTR1ASLC6A4
SCHEMBL6410063 0.95 SLC6A4 (0.54) HTR1ASLC6A4
SCHEMBL6416780 0.95 HTR1A (0.49) HTR1ASLC6A4DRD2
SCHEMBL6416778 0.95 HTR1A (0.49) HTR1ASLC6A4DRD2
SCHEMBL6410469 0.91 HTR1A (0.51) HTR1ASLC6A4DRD2HTR2A
SCHEMBL6410462 0.91 HTR1A (0.51) HTR1ASLC6A4DRD2HTR2A
SCHEMBL6415388 0.89 HTR1A (0.57) HTR1ASLC6A4DRD2HTR2A
SCHEMBL6415390 0.89 HTR1A (0.57) HTR1ASLC6A4DRD2HTR2A
SCHEMBL6413739 0.89 HTR1A (0.59) HTR1ASLC6A4DRD2HTR2A

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 1 patent. 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

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 HTR1A 1/4885SLC6A4 2/4885DRD2 79/4885

“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.