SCHEMBL6413897

SCHEMBL6413897

COc1ccc(Cl)c(CC2CCN(CC3CN(Cc4ccccc4)C(=O)S3)CC2)c1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 11/20 0.61
SLC6A4 P31645 10/20 0.61
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
KMT2A Q03164 1/20 0.48
SIGMAR1 Q99720 2/20 0.44
ACHE P22303 1/20 0.43
ALDH1A1 P00352 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL6418553 0.91 HTR1A (0.50) HTR1ASLC6A4MEN1POLBKMT2A
SCHEMBL6416088 0.91 HTR1A (0.49) HTR1ASLC6A4MEN1POLBKMT2A
SCHEMBL6416743 0.90 HTR1A (0.60) HTR1ASLC6A4MEN1POLBKMT2A
SCHEMBL6410448 0.89 HTR1A (0.52) HTR1ASLC6A4
SCHEMBL6411979 0.88 ALDH1A1 (0.45) HTR1ASLC6A4MEN1POLBKMT2A
SCHEMBL6413153 0.87 HTR1A (0.53) HTR1ASLC6A4
SCHEMBL6414071 0.86 HTR1A (0.57) HTR1ASLC6A4MEN1POLBKMT2A
SCHEMBL6410354 0.86 ATM (0.43) HTR1ASLC6A4MEN1KMT2ASIGMAR1
SCHEMBL6409968 0.83 HTR1A (0.62) HTR1ASLC6A4MEN1POLBKMT2A
SCHEMBL6415069 0.83 HTR1A (0.52) HTR1ASLC6A4SIGMAR1

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 2/4885MEN1 2067/4885

“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.