SCHEMBL3387334

SCHEMBL3387334

O=C(c1ccc(F)nc1)N1CCC[C@@H](O)C1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.52
GRM3 Q14832 1/20 0.51
VNN1 O95497 1/20 0.51
ALDH1A1 P00352 1/20 0.46
GRM5 P41594 1/20 0.46
JAK2 O60674 1/20 0.45
NTRK1 P04629 1/20 0.45
RECQL P46063 1/20 0.45
ALOX5AP P20292 2/20 0.44
FEN1 P39748 2/20 0.44

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
SCHEMBL3387338 1.00 SCN9A (0.52) SCN9AGRM3VNN1ALDH1A1GRM5
SCHEMBL8257885 1.00 SCN9A (0.52) SCN9AGRM3VNN1ALDH1A1GRM5
SCHEMBL4024286 0.84 GRM5 (0.58) ALDH1A1GRM5
SCHEMBL6265337 0.83 ALDH1A1 (0.64) GRM3VNN1ALDH1A1GRM5
SCHEMBL5909199 0.83 ALDH1A1 (0.64) GRM3VNN1ALDH1A1GRM5
SCHEMBL1972864 0.83 VNN1 (0.53) SCN9AVNN1ALDH1A1GRM5RECQL
SCHEMBL1972867 0.83 VNN1 (0.53) SCN9AVNN1ALDH1A1GRM5RECQL
SCHEMBL2821668 0.82 NPC1 (0.59) GRM3ALDH1A1GRM5
SCHEMBL1972661 0.82 NPC1 (0.59) GRM3ALDH1A1GRM5
SCHEMBL193622 0.82 NPC1 (0.59) GRM3ALDH1A1GRM5

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
EP-1809620-B1 NOVEL TETRAZOLE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2010-12-29 EP disclosed
US-20070299110-A1 Novel Tetrazole Derivatives as Positive Allosteric Modulators of Metabotropic Glutamate ADDEX PHARMACEUTICALS SA (CH) 2007-12-27 US disclosed
EP-1809620-A1 NOVEL TETRAZOLE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharma SA (CH) 2007-07-25 EP disclosed
WO-2006048771-A1 NOVEL TETRAZOLE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2006-05-11 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-20070299110-A1 Novel Tetrazole Derivatives as Positive Allosteric Modulators of Metabotropic Glutamate GRM5, GRIK5, GRM1 SCN9A 992/4885GRM3 5/4885VNN1 4637/4885

“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.