SCHEMBL6411218

SCHEMBL6411218

N[C@H]1CC[C@@H](CCCN2CCC(Cc3cc(Cl)ccc3Br)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 18/20 0.50
HTR1A P08908 17/20 0.50
SLC6A2 P23975 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
CYP2D6 P10635 2/20 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
SCHEMBL6410364 1.00 SLC6A4 (0.50) SLC6A4HTR1ASLC6A2KDM4EMEN1
SCHEMBL6410366 1.00 SLC6A4 (0.50) SLC6A4HTR1ASLC6A2KDM4EMEN1
SCHEMBL6414723 0.93 HTR1A (0.52) SLC6A4HTR1ANOS3NOS1NOS2
SCHEMBL6412453 0.93 HTR1A (0.52) SLC6A4HTR1ANOS3NOS1NOS2
SCHEMBL6412457 0.93 HTR1A (0.52) SLC6A4HTR1ANOS3NOS1NOS2
SCHEMBL6418341 0.89 SLC6A4 (0.50) SLC6A4HTR1ASLC6A2KDM4EMEN1
SCHEMBL6418172 0.89 SLC6A4 (0.50) SLC6A4HTR1ASLC6A2KDM4EMEN1
SCHEMBL6410735 0.89 SLC6A4 (0.50) SLC6A4HTR1ASLC6A2KDM4EMEN1
SCHEMBL6411795 0.86 HTR1A (0.50) SLC6A4HTR1A
SCHEMBL6411105 0.86 HTR1A (0.50) SLC6A4HTR1A

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 1/4885SLC6A2 3/4885

“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.