SCHEMBL6411343

SCHEMBL6411343

CCOc1ccc(Cl)c(CC2CCN(CC3COC(=O)N(Cc4ccccc4)C3)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.49
SLC6A4 P31645 3/20 0.49
CYP2D6 P10635 1/20 0.43
MAOB P27338 5/20 0.41
ACHE P22303 3/20 0.40
MAOA P21397 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HRH1 P35367 1/20 0.40
CCR3 P51677 1/20 0.40
ALDH1A1 P00352 2/20 0.39
ATM Q13315 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GRM2 Q14416 2/20 0.38
SIGMAR1 Q99720 1/20 0.38
BCHE P06276 1/20 0.38

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
SCHEMBL6413847 0.91 HTR1A (0.60) HTR1ASLC6A4ACHECCR3KMT2A
SCHEMBL6410918 0.91 HTR1A (0.50) HTR1ASLC6A4CYP2D6MAOBACHE
SCHEMBL6420212 0.90 HTR1A (0.45) HTR1ASLC6A4CYP2D6ACHEHRH1
SCHEMBL6412195 0.89 HTR1A (0.49) HTR1ASLC6A4CYP2D6MAOBHRH1
SCHEMBL6418137 0.89 HTR1A (0.47) HTR1ASLC6A4CYP2D6MAOBACHE
SCHEMBL6418448 0.87 HTR1A (0.50) HTR1ASLC6A4CYP2D6MAOBACHE
SCHEMBL6418145 0.87 HTR1A (0.46) HTR1ASLC6A4CYP2D6MAOBACHE
SCHEMBL6416995 0.87 ALDH1A1 (0.44) HTR1ASLC6A4ACHEL3MBTL1CCR3
SCHEMBL6409952 0.86 ATM (0.43) HTR1ASLC6A4L3MBTL1CCR3ALDH1A1
SCHEMBL6417821 0.83 HTR1A (0.45) HTR1ASLC6A4CYP2D6MAOBACHE

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 2/4885CYP2D6 323/4885

“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.