SCHEMBL5833101

SCHEMBL5833101

CN(C)Cc1ccccc1Sc1ccc(Br)cc1[N+](=O)[O-]

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 12/20 0.63
SLC6A2 P23975 8/20 0.63
SMN1; SMN2 Q16637 1/20 0.56
LMNA P02545 1/20 0.55
SLC6A3 Q01959 4/20 0.48
PDE7A Q13946 1/20 0.48
PDE7B Q9NP56 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL1645487 0.86 SLC6A4 (0.64) SLC6A4SLC6A2LMNASLC6A3TDP1
SCHEMBL1644437 0.86 SLC6A4 (0.64) SLC6A4SLC6A2LMNASLC6A3TDP1
SCHEMBL1644221 0.85 SLC6A4 (0.69) SLC6A4SLC6A2LMNASLC6A3PDE7A
SCHEMBL236212 0.85 SLC6A4 (0.64) SLC6A4SLC6A2LMNASLC6A3TDP1
SCHEMBL1645176 0.83 SLC6A4 (0.65) SLC6A4SLC6A2SLC6A3TDP1
SCHEMBL1645157 0.83 SLC6A4 (0.64) SLC6A4SLC6A2LMNASLC6A3TDP1
SCHEMBL1644194 0.83 SLC6A4 (0.65) SLC6A4SLC6A2LMNASLC6A3TDP1
SCHEMBL1645804 0.81 SLC6A4 (0.66) SLC6A4SLC6A2LMNASLC6A3TDP1
SCHEMBL1644224 0.79 SLC6A4 (0.67) SLC6A4SLC6A2LMNASLC6A3TDP1
SCHEMBL2746964 0.79 SLC6A4 (0.56) SLC6A4SLC6A2LMNASLC6A3TDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096623-B1 Method for preparing radiotracer precursor SnADAM Atomic Energy Council—Institute of Nuclear Energy Research (TW) 2015-08-04 US disclosed
US-7041851-B2 Fluorinated phenyl thiophenyl derivatives and their use for imaging serotonin transporters THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2006-05-09 US disclosed
US-20030236234-A1 Fluorinated phenyl thiophenyl derivatives and their use for imaging serotonin transporters NATIONAL INSTITUTES OF HEALTH-DIRECTOR DEITR 2003-12-25 US disclosed
WO-2003078393-A2 FLUORINATED PHENYL THIOPHENYL DERIVATIVES AND THEIR USE FOR IMAGING SEROTONIN TRANSPORTERS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2003-09-25 WO 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-20030236234-A1 Fluorinated phenyl thiophenyl derivatives and their use for imaging serotonin transporters SLC6A4, SLCO4C1, SLC6A2 SLC6A4 1/4885SLC6A2 3/4885SMN1; SMN2 3426/4885

“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.