SCHEMBL2173657

SCHEMBL2173657

CCC(c1[c]cccc1)N1CCNCC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 18/20 0.46
SLC6A2 P23975 15/20 0.46
SLC6A3 Q01959 6/20 0.41
CYP2D6 P10635 4/20 0.41
KCNH2 Q12809 4/20 0.41
CYP3A4 P08684 3/20 0.41
CACNA1F O60840 2/20 0.41
CACNA1D Q01668 2/20 0.41
CACNA1S Q13698 2/20 0.41
CACNA1C Q13936 2/20 0.41
HTR7 P34969 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CACNA2D1 P54289 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
SCHEMBL4307025 0.82 SLC6A4 (0.43) SLC6A4SLC6A2SLC6A3CYP2D6MEN1
SCHEMBL1855360 0.80 CHRM2 (0.46) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL4764069 0.76 MEN1 (0.43) SLC6A4SLC6A2SLC6A3CYP2D6MEN1
SCHEMBL3268419 0.76 SLC6A4 (0.68) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL7447748 0.74 MEN1 (0.67) SLC6A4SLC6A2CYP2D6CYP3A4MEN1
SCHEMBL2173663 0.73 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL3246700 0.71 SLC6A4 (0.63) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL9933670 0.70 SLC6A4 (0.55) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL3453995 0.70 SLC6A2 (0.61) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL28854342 0.70 SLC6A4 (0.41) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2346832-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS Glaxo Group Limited (GB) 2011-07-27 EP claimed
WO-2010049366-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2010-05-06 WO claimed
US-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2011-10-27 US disclosed
EP-2346832-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS Glaxo Group Limited (GB) 2011-07-27 EP disclosed
WO-2010049366-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2010-05-06 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-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GRM5, GRM1, GRM3 SLC6A4 173/4885SLC6A2 474/4885SLC6A3 263/4885

“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.