SCHEMBL6415045

SCHEMBL6415045

O=C1NC(CN2CCC(Cc3cc(F)ccc3Br)CC2)CCN1Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.43
SLC6A4 P31645 6/20 0.43
HTR1A P08908 4/20 0.43
CCR3 P51677 2/20 0.40
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL6412250 0.93 ATM (0.43) ATMSLC6A4HTR1ACCR3SIGMAR1
SCHEMBL6418500 0.91 HTR1A (0.46) ATMSLC6A4HTR1ACCR3
SCHEMBL6414760 0.90 ATM (0.44) ATMSLC6A4HTR1ACCR3SIGMAR1
SCHEMBL6412009 0.90 SLC6A4 (0.44) ATMSLC6A4HTR1ACCR3
SCHEMBL6412954 0.86 HTR1A (0.61) SLC6A4HTR1A
SCHEMBL6412836 0.85 HTR1A (0.46) ATMSLC6A4HTR1ACCR3
SCHEMBL6615250 0.85 MEN1 (0.43) ATMSLC6A4HTR1ACCR3SIGMAR1
SCHEMBL6416422 0.85 HTR1A (0.50) ATMSLC6A4HTR1A
SCHEMBL6410656 0.85 SLC6A4 (0.43) ATMSLC6A4HTR1A
SCHEMBL6411606 0.84 HTR1A (0.49) ATMSLC6A4HTR1A

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 4128/4885SLC6A4 2/4885HTR1A 1/4885

“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.