SCHEMBL5435867

SCHEMBL5435867

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

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 2/20 0.50
▸ TP53 P04637 3/20 0.48
▸ MAPT P10636 2/20 0.48
▸ CMA1 P23946 1/20 0.47
▸ GRM2 Q14416 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
▸ NPBWR1 P48145 1/20 0.46
▸ PDE5A O76074 1/20 0.45
▸ 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
▸ CHKA P35790 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
SCHEMBL5445065 0.94 SDHB (0.54) SDHBTP53MAPTCMA1GRM2
SCHEMBL5448579 0.89 MEN1 (0.56) SDHBTP53MAPTCMA1GRM2
SCHEMBL5197153 0.87 SDHB (0.49) SDHBTP53MAPTCMA1GRM2
SCHEMBL5196104 0.87 SDHB (0.49) SDHBTP53MAPTCMA1GRM2
SCHEMBL5430703 0.87 CNR1 (0.52) SDHBMAPTCMA1GRM2ALDH1A1
SCHEMBL5445050 0.87 HRH3 (0.55) SDHBTP53MAPTLMNAALDH1A1
SCHEMBL5437510 0.87 MKNK1 (0.56) SDHBTP53MAPTCMA1GRM2
SCHEMBL5441396 0.86 GRM2 (0.49) SDHBTP53MAPTCMA1GRM2
SCHEMBL5441351 0.86 P2RX7 (0.53) SDHBTP53MAPT
SCHEMBL5437535 0.86 NPBWR1 (0.52) SDHBTP53MAPTCMA1LMNA

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 SDHB 1074/4885TP53 4883/4885MAPT 2615/4885
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRIA2 SDHB 1134/4885TP53 4883/4885MAPT 2062/4885

“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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