SCHEMBL5435658

SCHEMBL5435658

COc1ccc(-c2ccc(=O)n(Cc3ccc(C(F)(F)F)cc3F)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.42
▸ HSP90AB1 P08238 1/20 0.42
▸ MKNK1 Q9BUB5 5/20 0.41
▸ MKNK2 Q9HBH9 5/20 0.41
▸ PTGDR2 Q9Y5Y4 3/20 0.40
▸ SCN5A Q14524 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL5442659 0.86 PTGDR2 (0.52) SDHBALDH1A1SMN1; SMN2MKNK1MKNK2
SCHEMBL5197304 0.84 MAPT (0.49) SDHBALDH1A1TP53SMN1; SMN2MKNK1
SCHEMBL5444680 0.82 SDHB (0.57) SDHBALDH1A1TP53SMN1; SMN2HSP90AA1
SCHEMBL5441383 0.81 MAPT (0.57) ALDH1A1TP53SMN1; SMN2MKNK1MKNK2
SCHEMBL5440937 0.80 MAPT (0.50) SDHBSMN1; SMN2MKNK1MKNK2PTGDR2
SCHEMBL5444851 0.77 SDHB (0.52) SDHBALDH1A1TP53HSP90AA1HSP90AB1
SCHEMBL5439738 0.76 MAPT (0.45) SDHBALDH1A1TP53SMN1; SMN2MKNK1
SCHEMBL5433988 0.76 SDHB (0.43) SDHBSMN1; SMN2MKNK1MKNK2PTGDR2
SCHEMBL5443008 0.75 SDHB (0.49) SDHBTP53
SCHEMBL6116487 0.74 ALDH1A1 (0.65) SDHBALDH1A1TP53SMN1; SMN2KMT2A

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 1074/4885ALDH1A1 3403/4885TP53 4883/4885
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRIA2 SDHB 1134/4885ALDH1A1 2717/4885TP53 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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