SCHEMBL5441499

SCHEMBL5441499

COc1ccc(-c2ccc(=O)n(Cc3ccc(Cl)c(C(F)(F)F)c3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 6/20 0.54
▸ MKNK1 Q9BUB5 2/20 0.43
▸ MKNK2 Q9HBH9 2/20 0.43
▸ TP53 P04637 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ SCD O00767 1/20 0.41
▸ IDO1 P14902 1/20 0.40
▸ PDE5A O76074 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL5437510 0.86 MKNK1 (0.56) SDHBMKNK1MKNK2TP53MAPT
SCHEMBL5444851 0.85 SDHB (0.52) SDHBMKNK1MKNK2TP53MAPT
SCHEMBL5442655 0.85 SDHB (0.49) SDHBMKNK1MKNK2TP53MAPT
SCHEMBL5444680 0.83 SDHB (0.57) SDHBMKNK1MKNK2TP53MAPT
SCHEMBL5445065 0.83 SDHB (0.54) SDHBTP53MAPTALDH1A1LMNA
SCHEMBL5441351 0.83 P2RX7 (0.53) SDHBMKNK1MKNK2TP53MAPT
SCHEMBL5445058 0.81 SDHB (0.54) SDHBTP53ALDH1A1LMNAPDE5A
SCHEMBL5435867 0.81 SDHB (0.50) SDHBTP53MAPTALDH1A1LMNA
SCHEMBL5430703 0.80 CNR1 (0.52) SDHBMAPTALDH1A1
SCHEMBL5443008 0.79 SDHB (0.49) SDHBTP53MAPTLMNAPDE5A

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 1074/4885MKNK1 2293/4885MKNK2 1366/4885
US-20130109652-A1 NOVEL PYRIDINONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRIA2 SDHB 1134/4885MKNK1 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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