SCHEMBL6418448

SCHEMBL6418448

CCOc1ccc(Cl)c(CC2CCN(CC3CN(Cc4ccccc4)C(=O)O3)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.50
SLC6A4 P31645 3/20 0.50
GRM2 Q14416 3/20 0.43
MAOB P27338 4/20 0.42
CYP2D6 P10635 1/20 0.42
ACHE P22303 5/20 0.41
MAOA P21397 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 2/20 0.40
ATM Q13315 1/20 0.40
BCHE P06276 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HRH1 P35367 1/20 0.38
CCR3 P51677 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
SCHEMBL6411962 0.91 HTR1A (0.61) HTR1ASLC6A4ACHESIGMAR1MEN1
SCHEMBL6413644 0.91 HTR1A (0.49) HTR1ASLC6A4GRM2MAOBCYP2D6
SCHEMBL6414497 0.89 HTR1A (0.44) HTR1ASLC6A4GRM2MAOBCYP2D6
SCHEMBL6411207 0.89 HTR1A (0.49) HTR1ASLC6A4GRM2MAOBCYP2D6
SCHEMBL6416536 0.89 HTR1A (0.45) HTR1ASLC6A4GRM2MAOBCYP2D6
SCHEMBL6411343 0.87 HTR1A (0.49) HTR1ASLC6A4GRM2MAOBCYP2D6
SCHEMBL6415186 0.87 GRM2 (0.50) HTR1ASLC6A4GRM2SIGMAR1
SCHEMBL6411591 0.86 ALDH1A1 (0.45) HTR1ASLC6A4ACHEL3MBTL1ALDH1A1
SCHEMBL6410904 0.85 ATM (0.43) HTR1ASLC6A4GRM2L3MBTL1ALDH1A1
SCHEMBL6413344 0.83 HTR1A (0.51) HTR1ASLC6A4MAOBCYP2D6ACHE

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 2/4885GRM2 97/4885

“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.