SCHEMBL5437292

SCHEMBL5437292

COc1ccc(Cc2ccc(=O)n(Cc3ccc(Cl)cc3F)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.47
▸ TP53 P04637 2/20 0.43
▸ PTGDR2 Q9Y5Y4 2/20 0.42
▸ CHRM1 P11229 1/20 0.41
▸ SDHB P21912 1/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ CMA1 P23946 1/20 0.39
▸ PTGS2 P35354 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ P2RX7 Q99572 2/20 0.38
▸ CCR2 P41597 1/20 0.38

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
SCHEMBL5447834 0.89 MAPT (0.45) MAPTTP53CHRM1SDHBSMN1; SMN2
SCHEMBL5197304 0.86 MAPT (0.49) MAPTTP53PTGDR2CHRM1SDHB
SCHEMBL5430779 0.84 MAPT (0.53) MAPTTP53PTGDR2ALDH1A1P2RX7
SCHEMBL14892083 0.82 DRD2 (0.46) MAPTTP53PTGDR2CMA1CCR2
SCHEMBL5431527 0.82 MAOB (0.47) MAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL5447828 0.78 MAPT (0.40) MAPTTP53CHRM1P2RX7
SCHEMBL5197080 0.78 NLRP3 (0.43) MAPTTP53CHRM1ALDH1A1GAA
SCHEMBL5433218 0.77 MAPT (0.53) MAPTTP53
SCHEMBL5198153 0.76 MAPT (0.39) MAPTTP53PTGDR2CHRM1P2RX7
SCHEMBL5431584 0.76 CNR1 (0.42) MAPTTP53CHRM1ALDH1A1GAA

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 MAPT 2615/4885TP53 4883/4885PTGDR2 85/4885
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRIA2 MAPT 2062/4885TP53 4883/4885PTGDR2 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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