SCHEMBL6419396

SCHEMBL6419396

CN1C(=O)N(Cc2ccccc2)CCC1CN1CCC(Cc2cc(Cl)ccc2Br)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 12/20 0.47
HTR1A P08908 9/20 0.47
ATM Q13315 2/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SLC6A2 P23975 3/20 0.40
ACHE P22303 1/20 0.40

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
SCHEMBL6414869 0.93 SLC6A4 (0.47) SLC6A4HTR1AATMALDH1A1KDM4E
SCHEMBL6411812 0.91 SLC6A4 (0.48) SLC6A4HTR1AATMALDH1A1KDM4E
SCHEMBL6412511 0.90 HTR1A (0.46) SLC6A4HTR1AATMACHE
SCHEMBL6411764 0.88 HTR1A (0.63) SLC6A4HTR1A
SCHEMBL6411326 0.87 HTR1A (0.52) SLC6A4HTR1A
SCHEMBL6414833 0.87 HTR1A (0.52) SLC6A4HTR1AKDM4E
SCHEMBL6411776 0.86 SLC6A4 (0.44) SLC6A4HTR1ASLC6A2
SCHEMBL6614539 0.85 SLC6A4 (0.46) SLC6A4HTR1AATMALDH1A1KDM4E
SCHEMBL6418767 0.83 SLC6A4 (0.48) SLC6A4HTR1AATMALDH1A1KDM4E
SCHEMBL6410588 0.83 HTR1A (0.46) SLC6A4HTR1AATM

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 SLC6A4 2/4885HTR1A 1/4885ATM 4128/4885

“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.