SCHEMBL5437535

SCHEMBL5437535

COc1ccc(Oc2ccc(=O)n(Cc3ccc(Cl)cc3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 3/20 0.52
▸ MAPT P10636 3/20 0.48
▸ TP53 P04637 2/20 0.48
▸ CMA1 P23946 1/20 0.47
▸ LMNA P02545 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ GSK3A P49840 1/20 0.45
▸ GSK3B P49841 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ FABP6 P51161 1/20 0.44
▸ MMP1 P03956 1/20 0.44
▸ MMP9 P14780 1/20 0.44
▸ MMP13 P45452 1/20 0.44
▸ ADAM17 P78536 1/20 0.44
▸ S1PR5 Q9H228 1/20 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
SCHEMBL5194377 0.86 HRH3 (0.47) NPBWR1MAPTTP53CMA1LMNA
SCHEMBL5435867 0.86 SDHB (0.50) NPBWR1MAPTTP53CMA1LMNA
SCHEMBL5184227 0.86 MAPT (0.55) MAPTALDH1A1SMN1; SMN2FABP6S1PR5
SCHEMBL5197211 0.83 HRH3 (0.47) NPBWR1MAPTTP53CMA1LMNA
SCHEMBL23168931 0.79 NPBWR1 (0.46) NPBWR1MAPTTP53CMA1LMNA
SCHEMBL5445065 0.79 SDHB (0.54) MAPTTP53CMA1LMNAALDH1A1
SCHEMBL8276905 0.79 CMA1 (0.53) NPBWR1MAPTTP53CMA1LMNA
SCHEMBL5437583 0.79 L3MBTL1 (0.45) MAPTTP53LMNAALDH1A1SMN1; SMN2
SCHEMBL5442729 0.78 L3MBTL1 (0.47) MAPTTP53LMNAALDH1A1SMN1; SMN2
SCHEMBL2458827 0.78 CMA1 (0.51) MAPTTP53CMA1LMNAALDH1A1

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 NPBWR1 611/4885MAPT 2615/4885TP53 4883/4885
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRIA2 NPBWR1 1177/4885MAPT 2062/4885TP53 4883/4885

“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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