SCHEMBL4229677

SCHEMBL4229677

O=C(c1ccc(F)cc1)N1CCCC(c2noc(-c3ccncc3F)n2)C1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.54
CLPP Q16740 1/20 0.54
ATM Q13315 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
POLB P06746 2/20 0.48
HSD11B1 P28845 3/20 0.44
NAMPT P43490 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL4229669 1.00 GRM5 (0.54) GRM5CLPPATML3MBTL1MEN1
SCHEMBL4226630 0.91 PDE2A (0.48) GRM5CLPPMEN1KMT2APOLB
SCHEMBL4226622 0.91 PDE2A (0.48) GRM5CLPPMEN1KMT2APOLB
SCHEMBL4223992 0.87 GRM5 (0.57) GRM5CLPPATML3MBTL1MEN1
SCHEMBL4233167 0.86 GRM5 (0.60) GRM5CLPPATML3MBTL1MEN1
SCHEMBL4233384 0.84 GRM5 (0.68) GRM5CLPPATML3MBTL1MEN1
SCHEMBL412929 0.84 GRM5 (0.68) GRM5CLPPATML3MBTL1MEN1
SCHEMBL4232189 0.84 GRM5 (0.68) GRM5CLPPATML3MBTL1MEN1
SCHEMBL4228317 0.83 HSD11B1 (0.55) GRM5CLPPMEN1KMT2APOLB
SCHEMBL4228326 0.83 HSD11B1 (0.55) GRM5CLPPMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215822-A1 Substituted Oxadiazole Derivatives as Positive Allosteric Modulators of Metabotropic Glutamate Receptors NIKEM RESEARCH SRL (IT) 2009-08-27 US disclosed
EP-1893606-A2 SUBSTITUTED OXADIAZOLE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharma SA (CH) 2008-03-05 EP disclosed
WO-2006123255-A2 SUBSTITUTED OXADIAZOLE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2006-11-23 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-20090215822-A1 Substituted Oxadiazole Derivatives as Positive Allosteric Modulators of Metabotropic Glutamate Receptors GRM5, GRM3, GRM2 GRM5 1/4885CLPP 4652/4885ATM 4084/4885

“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.