SCHEMBL6411174

SCHEMBL6411174

COc1ccc(Cl)c(CC2CCN(CC3CN(C(C)C)C(=O)S3)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 16/20 0.52
SLC6A4 P31645 16/20 0.52
CCR3 P51677 2/20 0.39
CCR5 P51681 1/20 0.39
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
HRH1 P35367 1/20 0.37
KCNH2 Q12809 1/20 0.37
CCR2 P41597 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
SCHEMBL6417229 0.92 HTR1A (0.43) HTR1ASLC6A4CCR3HRH1KCNH2
SCHEMBL6413917 0.91 HTR1A (0.42) HTR1ASLC6A4CCR3POLBHRH1
SCHEMBL6416758 0.89 SLC6A4 (0.53) HTR1ASLC6A4
SCHEMBL6411542 0.88 CCR3 (0.39) HTR1ASLC6A4CCR3MEN1POLB
SCHEMBL6416736 0.87 CCR3 (0.36) HTR1ASLC6A4CCR3CCR5MEN1
SCHEMBL6410448 0.86 HTR1A (0.52) HTR1ASLC6A4CCR3CCR5CCR2
SCHEMBL6415069 0.85 HTR1A (0.52) HTR1ASLC6A4CCR3CCR5CCR2
SCHEMBL6413153 0.84 HTR1A (0.53) HTR1ASLC6A4CCR3CCR5
SCHEMBL6413317 0.83 HTR1A (0.50) HTR1ASLC6A4CCR3CCR5MEN1
SCHEMBL6414071 0.83 HTR1A (0.57) HTR1ASLC6A4MEN1POLBKMT2A

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 2/4885CCR3 4569/4885

“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.