SCHEMBL6410119

SCHEMBL6410119

O=C1OC(CN2CCC(Cc3cc(F)ccc3Br)CC2)CN1Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.43
HTR1A P08908 6/20 0.42
SLC6A4 P31645 5/20 0.42
SIGMAR1 Q99720 4/20 0.41
CCR3 P51677 2/20 0.39
GRM2 Q14416 2/20 0.38
HTR2A P28223 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
SCHEMBL6419342 0.91 SLC6A4 (0.45) ATMHTR1ASLC6A4CCR3
SCHEMBL6410904 0.90 ATM (0.43) ATMHTR1ASLC6A4SIGMAR1CCR3
SCHEMBL6417687 0.90 HTR1A (0.44) ATMHTR1ASLC6A4SIGMAR1CCR3
SCHEMBL6414874 0.88 SLC6A4 (0.42) HTR1ASLC6A4SIGMAR1CCR3HTR2A
SCHEMBL6415988 0.87 ATM (0.43) ATMHTR1ASLC6A4SIGMAR1CCR3
SCHEMBL6415187 0.86 HTR1A (0.60) HTR1ASLC6A4
SCHEMBL6413644 0.85 HTR1A (0.49) HTR1ASLC6A4GRM2
SCHEMBL6419379 0.85 SLC6A4 (0.44) HTR1ASLC6A4
SCHEMBL6416588 0.85 SIGMAR1 (0.47) HTR1ASLC6A4SIGMAR1GRM2
SCHEMBL6411509 0.84 HTR1A (0.49) HTR1ASLC6A4GRM2

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 ATM 4128/4885HTR1A 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.