SCHEMBL5441383

SCHEMBL5441383

COc1ccc(-c2ccc(=O)n(Cc3ccccc3F)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.57
▸ MKNK1 Q9BUB5 2/20 0.54
▸ MKNK2 Q9HBH9 2/20 0.54
▸ SMN1; SMN2 Q16637 5/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ TP53 P04637 2/20 0.45
▸ NFKB1 P19838 1/20 0.44
▸ CASP3 P42574 1/20 0.44
▸ NFKB2 Q00653 1/20 0.44
▸ RELA Q04206 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ SENP8 Q96LD8 1/20 0.44
▸ SENP7 Q9BQF6 1/20 0.44
▸ SENP6 Q9GZR1 1/20 0.44
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ GNRHR P30968 3/20 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
SCHEMBL5439738 0.90 MAPT (0.45) MAPTMKNK1MKNK2SMN1; SMN2NPC1
SCHEMBL5431656 0.85 MAPT (0.55) MAPTALDH1A1TP53MEN1KMT2A
SCHEMBL5442659 0.85 PTGDR2 (0.52) MAPTMKNK1MKNK2SMN1; SMN2ALDH1A1
SCHEMBL5433228 0.84 MEN1 (0.54) MAPTMKNK1MKNK2TP53MEN1
SCHEMBL5197304 0.83 MAPT (0.49) MAPTMKNK1MKNK2SMN1; SMN2ALDH1A1
SCHEMBL5435658 0.81 SDHB (0.46) MKNK1MKNK2SMN1; SMN2ALDH1A1TP53
SCHEMBL5445050 0.81 HRH3 (0.55) MAPTMKNK1MKNK2NPC1RAB9A
SCHEMBL5433988 0.79 SDHB (0.43) MKNK1MKNK2SMN1; SMN2MEN1KMT2A
SCHEMBL5445065 0.79 SDHB (0.54) MAPTSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL5430703 0.78 CNR1 (0.52) MAPTSMN1; SMN2ALDH1A1NPSR1MEN1

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 2615/4885MKNK1 2293/4885MKNK2 1366/4885
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRIA2 MAPT 2062/4885MKNK1 1868/4885MKNK2 1100/4885

“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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