SCHEMBL5435694

SCHEMBL5435694

O=C(O)Cc1ccc(-c2ccc(=O)n(Cc3ccc(Cl)cc3)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ PTGDR2 Q9Y5Y4 4/20 0.47
▸ ABCC4 O15439 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ PTGS1 P23219 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ FABP6 P51161 1/20 0.47
▸ PTGS2 P35354 2/20 0.43
▸ SDHB P21912 1/20 0.42
▸ ENPP2 Q13822 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ DRD2 P14416 1/20 0.41
▸ BRD4 O60885 1/20 0.41
▸ BRD2 P25440 1/20 0.41
▸ BRD3 Q15059 1/20 0.41
▸ BRDT Q58F21 1/20 0.41
▸ MKNK1 Q9BUB5 1/20 0.41

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
SCHEMBL16275004 0.87 PTGDR2 (0.50) ALDH1A1SMN1; SMN2PTGDR2LMNAFABP6
SCHEMBL5434479 0.86 FFAR1 (0.50) ALDH1A1SMN1; SMN2PTGDR2FABP6
SCHEMBL16274898 0.86 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2PTGDR2LMNATSHR
SCHEMBL5433212 0.85 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2PTGDR2FABP6SDHB
SCHEMBL5184873 0.84 FABP6 (0.46) ALDH1A1SMN1; SMN2PTGDR2LMNAGAA
SCHEMBL5444586 0.84 FABP6 (0.46) ALDH1A1SMN1; SMN2PTGDR2LMNAGAA
SCHEMBL5435842 0.84 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2PTGDR2LMNAHTT
SCHEMBL5439784 0.84 FABP6 (0.47) ALDH1A1SMN1; SMN2PTGDR2LMNAGAA
SCHEMBL5195278 0.84 FABP6 (0.47) ALDH1A1SMN1; SMN2PTGDR2GAAFABP6
SCHEMBL5438403 0.83 MKNK1 (0.54) ALDH1A1SMN1; SMN2PTGDR2SDHBBRD4

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
EP-1799646-B1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS JANSSEN PHARMACEUTICALS INC (US) 2014-12-10 — — EP disclosed
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 ALDH1A1 3403/4885SMN1; SMN2 1523/4885PTGDR2 85/4885
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRIA2 ALDH1A1 2717/4885SMN1; SMN2 1675/4885PTGDR2 78/4885

“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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