SCHEMBL6410353

SCHEMBL6410353

COc1ccc(Cl)c(CC2CCN(CC3CN(C(C)C)C(=O)O3)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 11/20 0.52
SLC6A4 P31645 11/20 0.52
HTR2B P41595 1/20 0.46
SIGMAR1 Q99720 6/20 0.43
CCR3 P51677 1/20 0.39
CCR5 P51681 1/20 0.39

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
SCHEMBL6409832 0.92 HTR2B (0.46) HTR1ASLC6A4HTR2BSIGMAR1CCR3
SCHEMBL6412577 0.91 HTR2B (0.45) HTR1ASLC6A4HTR2BSIGMAR1CCR3
SCHEMBL6415197 0.89 HTR1A (0.53) HTR1ASLC6A4HTR2BSIGMAR1
SCHEMBL6417021 0.88 HTR2B (0.49) HTR1ASLC6A4HTR2BSIGMAR1CCR3
SCHEMBL6418105 0.87 HTR2B (0.48) HTR1ASLC6A4HTR2BSIGMAR1CCR3
SCHEMBL6410720 0.86 HTR1A (0.51) HTR1ASLC6A4SIGMAR1CCR3CCR5
SCHEMBL6412827 0.86 HTR1A (0.52) HTR1ASLC6A4SIGMAR1CCR3CCR5
SCHEMBL6411178 0.85 SIGMAR1 (0.60) HTR1ASLC6A4SIGMAR1
SCHEMBL6418861 0.84 HTR1A (0.53) HTR1ASLC6A4SIGMAR1
SCHEMBL6418304 0.84 HTR1A (0.50) HTR1ASLC6A4HTR2BSIGMAR1

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 HTR1A 1/4885SLC6A4 2/4885HTR2B 6/4885

“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.