SCHEMBL5433860

SCHEMBL5433860

CC(C)Oc1ccc(-c2ccc(=O)n(Cc3ccc(Cl)cc3)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 12/20 0.55
KMT2A Q03164 1/20 0.43
SDHB P21912 1/20 0.43
FABP6 P51161 1/20 0.42
S1PR1 P21453 2/20 0.41
MAP4K4 O95819 1/20 0.41
HRH3 Q9Y5N1 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
SCHEMBL5435848 0.89 P2RX3 (0.43) P2RX3SDHBFABP6HRH3
SCHEMBL5435867 0.85 SDHB (0.50) SDHBFABP6
SCHEMBL5443085 0.82 SDHB (0.45) P2RX3KMT2ASDHBFABP6
SCHEMBL16275055 0.82 PPARA (0.54)
SCHEMBL5439647 0.80 MAPT (0.49) KMT2ASDHBFABP6S1PR1
SCHEMBL5448763 0.80 SDHB (0.45) KMT2ASDHBFABP6HRH3
SCHEMBL5442895 0.80 SDHB (0.41) KMT2ASDHBFABP6
SCHEMBL5431593 0.79 SDHB (0.43) KMT2ASDHBFABP6
SCHEMBL5445065 0.79 SDHB (0.54) KMT2ASDHBHRH3
SCHEMBL5433212 0.79 ALDH1A1 (0.53) KMT2ASDHBFABP6

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 P2RX3 56/4885KMT2A 1937/4885SDHB 1074/4885
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRIA2 P2RX3 70/4885KMT2A 1513/4885SDHB 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.