SCHEMBL5430703

SCHEMBL5430703

COc1ccc(-c2ccc(=O)n(Cc3ccc(F)cc3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 2/20 0.52
▸ CNR2 P34972 2/20 0.52
▸ SDHB P21912 1/20 0.52
▸ MET P08581 1/20 0.48
▸ RGS4 P49798 1/20 0.48
▸ RGS8 P57771 1/20 0.48
▸ KDM4E B2RXH2 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ MAPT P10636 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ NTSR1 P30989 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ PAX8 Q06710 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ TLR9 Q9NR96 1/20 0.47
▸ BACE1 P56817 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL5445065 0.93 SDHB (0.54) SDHBKDM4EALDH1A1MAPTKMT2A
SCHEMBL5435867 0.87 SDHB (0.50) SDHBALDH1A1MAPTPOLBSMN1; SMN2
SCHEMBL5448579 0.87 MEN1 (0.56) SDHBRGS4KDM4EALDH1A1MAPT
SCHEMBL5439611 0.86 GSK3A (0.47) CNR1CNR2RGS4RGS8KDM4E
SCHEMBL5196104 0.86 SDHB (0.49) SDHBMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL5197153 0.86 SDHB (0.49) CNR1CNR2SDHBMAPTKMT2A
SCHEMBL5445050 0.86 HRH3 (0.55) SDHBKDM4EALDH1A1MAPTKMT2A
SCHEMBL5445058 0.85 SDHB (0.54) SDHBALDH1A1CMA1GRM2
SCHEMBL5443008 0.85 SDHB (0.49) CNR1CNR2SDHBMAPT
SCHEMBL5444680 0.85 SDHB (0.57) SDHBALDH1A1MAPTKMT2APOLB

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-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS ADDEX PHARMACEUTICALS S.A. (CH) 2013-05-02 — — US claimed
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS ADDEX PHARMACEUTICALS S.A. (CH) 2013-05-02 — — US disclosed
US-8399493-B2 Pyridinone derivatives and their use as positive allosteric modulators of mGluR2-receptors Janssen Pharmaceuticals, Inc. (US) 2013-03-19 — — US disclosed
US-20070213323-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS Janssen Pharmaceuticals, Inc. 2007-09-13 — — US 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-20070213323-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRM3 CNR1 31/4885CNR2 29/4885SDHB 1074/4885
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRIA2 CNR1 45/4885CNR2 28/4885SDHB 1134/4885

“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.

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