SCHEMBL6409832

SCHEMBL6409832

CC(C)Oc1ccc(Cl)c(CC2CCN(CC3CN(C(C)C)C(=O)O3)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.46
HTR1A P08908 6/20 0.45
SLC6A4 P31645 6/20 0.45
CYP2D6 P10635 1/20 0.45
HRH1 P35367 5/20 0.37
CCR3 P51677 5/20 0.37
SIGMAR1 Q99720 4/20 0.37
FFAR4 Q5NUL3 1/20 0.36
PTGDR Q13258 1/20 0.35
KCNH2 Q12809 1/20 0.34

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
SCHEMBL6410353 0.92 HTR1A (0.52) HTR2BHTR1ASLC6A4CCR3SIGMAR1
SCHEMBL6412577 0.90 HTR2B (0.45) HTR2BHTR1ASLC6A4CYP2D6HRH1
SCHEMBL6409943 0.89 HTR1A (0.51) HTR2BHTR1ASLC6A4CYP2D6
SCHEMBL6411226 0.88 HTR1A (0.45) HTR1ASLC6A4CYP2D6HRH1CCR3
SCHEMBL6417021 0.88 HTR2B (0.49) HTR2BHTR1ASLC6A4CCR3SIGMAR1
SCHEMBL6411835 0.86 HTR1A (0.46) HTR1ASLC6A4CYP2D6HRH1CCR3
SCHEMBL6411535 0.86 HTR1A (0.47) HTR1ASLC6A4CYP2D6HRH1CCR3
SCHEMBL6411733 0.86 GRM2 (0.47) HTR1ASLC6A4CYP2D6SIGMAR1
SCHEMBL6411199 0.86 SIGMAR1 (0.51) HTR1ASLC6A4CYP2D6SIGMAR1
SCHEMBL6411316 0.86 HTR2B (0.46) HTR2BHTR1ASLC6A4CYP2D6HRH1

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

“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.