SCHEMBL2612600

SCHEMBL2612600

Cc1cc(-c2nc(CN3CCNC[C@@H]3C)no2)cc2c1C(=O)N(Cc1ccc(Cl)cc1)C2

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.61
USP7 Q93009 1/20 0.36
OPRL1 P41146 3/20 0.33
PLAT P00750 1/20 0.33
SOS1 Q07889 1/20 0.33
KCNH2 Q12809 4/20 0.32
HRH3 Q9Y5N1 2/20 0.32
MAPK1 P28482 3/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
ERCC1 P07992 1/20 0.31
ERCC4 Q92889 1/20 0.31

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
SCHEMBL30789126 1.00 GRM2 (0.61) GRM2USP7OPRL1PLATSOS1
SCHEMBL2612606 1.00 GRM2 (0.61) GRM2USP7OPRL1PLATSOS1
SCHEMBL2122944 1.00 GRM2 (0.61) GRM2USP7OPRL1PLATSOS1
SCHEMBL15098092 0.88 GRM2 (0.54) GRM2OPRL1MAPK1KDM4EALDH1A1
SCHEMBL30789127 0.87 GRM2 (0.78) GRM2OPRL1PLATSOS1KCNH2
SCHEMBL2123824 0.87 GRM2 (0.78) GRM2OPRL1PLATSOS1KCNH2
SCHEMBL8122370 0.87 GRM2 (0.47) GRM2USP7SOS1KCNH2MAPK1
SCHEMBL8122366 0.87 GRM2 (0.47) GRM2USP7SOS1KCNH2MAPK1
SCHEMBL2123310 0.87 GRM2 (0.47) GRM2USP7SOS1KCNH2MAPK1
SCHEMBL2123528 0.83 GRM2 (0.64) GRM2OPRL1PLATKCNH2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377939-B2 Oxadiazole derivatives and their use as metabotropic glutamate receptor potentiators 842 ASTRAZENECA AB (SE) 2013-02-19 US disclosed
US-8377939-B2 Oxadiazole derivatives and their use as metabotropic glutamate receptor potentiators 842 ASTRAZENECA AB (SE) 2013-02-19 US disclosed
US-8377940-B2 Oxadiazole derivatives and their use as metabotropic glutamate receptor potentiators—842 ASTRAZENECA AB (SE) 2013-02-19 US disclosed
US-8377940-B2 Oxadiazole derivatives and their use as metabotropic glutamate receptor potentiators—842 ASTRAZENECA AB (SE) 2013-02-19 US disclosed
EP-2167502-B1 OXADIAZOLE DERIVATIVES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS - 842 ASTRAZENECA AB (SE) 2012-09-19 EP disclosed
EP-2444399-A1 Oxadiazole derivatives and their use as metabotropic glutamate receptor potentiators - 842 AstraZeneca AB (SE) 2012-04-25 EP disclosed
US-20100267740-A1 Oxadiazole Derivatives and Their Use as Metabotropic Glutamate Receptor Potentiators - 842 ASTRAZENECA AB (SE) 2010-10-21 US disclosed
US-20100267740-A1 Oxadiazole Derivatives and Their Use as Metabotropic Glutamate Receptor Potentiators - 842 ASTRAZENECA AB (SE) 2010-10-21 US disclosed
US-20080306077-A1 Oxadiazole Derivatives and Their Use as Metabotropic Glutamate Receptor Potentiators 842 ASTRAZENECA AB (SE) 2008-12-11 US disclosed
US-20080306077-A1 Oxadiazole Derivatives and Their Use as Metabotropic Glutamate Receptor Potentiators 842 ASTRAZENECA AB (SE) 2008-12-11 US disclosed
WO-2008150233-A1 OXADIAZOLE DERIVATIVES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS - 842 ASTRAZENECA AB (SE) 2008-12-11 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 (2 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-20080306077-A1 Oxadiazole Derivatives and Their Use as Metabotropic Glutamate Receptor Potentiators 842 GRM1, GRIN1, GRM2 GRM2 3/4885USP7 3477/4885OPRL1 106/4885
US-20100267740-A1 Oxadiazole Derivatives and Their Use as Metabotropic Glutamate Receptor Potentiators - 842 GRM1, GRM2, GRIN1 GRM2 2/4885USP7 3491/4885OPRL1 105/4885

“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.