SCHEMBL3141089

SCHEMBL3141089

O=C(c1ccc(F)cc1)N1CCCC(c2nc(Oc3ccc(F)cc3)no2)C1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.70
▸ CLPP Q16740 1/20 0.70
▸ KMT2A Q03164 3/20 0.69
▸ MEN1 O00255 2/20 0.69
▸ L3MBTL1 Q9Y468 2/20 0.62
▸ ATM Q13315 1/20 0.62
▸ POLB P06746 2/20 0.56
▸ HSD11B1 P28845 2/20 0.55
▸ TSHR P16473 2/20 0.55
▸ HPGD P15428 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ PKM P14618 1/20 0.54
▸ MAPK1 P28482 1/20 0.53

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
SCHEMBL4620646 0.95 GRM5 (0.67) GRM5CLPPKMT2AMEN1L3MBTL1
SCHEMBL3137282 0.95 GRM5 (0.67) GRM5CLPPKMT2AMEN1L3MBTL1
SCHEMBL3146200 0.90 GRM5 (0.63) GRM5CLPPKMT2AMEN1L3MBTL1
SCHEMBL3140639 0.90 GRM5 (0.63) GRM5CLPPKMT2AMEN1L3MBTL1
SCHEMBL3141476 0.86 L3MBTL1 (0.58) GRM5CLPPKMT2AMEN1L3MBTL1
SCHEMBL3137500 0.86 ALDH1A1 (0.66) KMT2AMEN1L3MBTL1HSD11B1TSHR
SCHEMBL3137493 0.86 ALDH1A1 (0.66) KMT2AMEN1L3MBTL1HSD11B1TSHR
SCHEMBL3141460 0.86 L3MBTL1 (0.58) GRM5CLPPKMT2AMEN1L3MBTL1
SCHEMBL3130701 0.85 L3MBTL1 (0.67) GRM5CLPPKMT2AMEN1L3MBTL1
SCHEMBL3130688 0.85 L3MBTL1 (0.67) GRM5CLPPKMT2AMEN1L3MBTL1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004284-A1 Novel Heterocyclic Compounds as Positive Allosteric Modulators of Metabotropic Glutamate Receptors ADDEX PHARMA SA (CH) 2010-01-07 — — US claimed
US-20100004284-A1 Novel Heterocyclic Compounds as Positive Allosteric Modulators of Metabotropic Glutamate Receptors ADDEX PHARMA SA (CH) 2010-01-07 — — US disclosed
US-20100004284-A1 Novel Heterocyclic Compounds as Positive Allosteric Modulators of Metabotropic Glutamate Receptors ADDEX PHARMA SA (CH) 2010-01-07 — — US disclosed
US-20100004284-A1 Novel Heterocyclic Compounds as Positive Allosteric Modulators of Metabotropic Glutamate Receptors ADDEX PHARMA SA (CH) 2010-01-07 — — US disclosed
EP-1896464-A1 NOVEL HETEROCYCLIC COMPOUNDS AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharma SA (CH) 2008-03-12 — — EP disclosed
WO-2006129199-A1 NOVEL HETEROCYCLIC COMPOUNDS AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2006-12-07 — — WO disclosed
WO-2006129199-A1 NOVEL HETEROCYCLIC COMPOUNDS AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2006-12-07 — — WO 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 (1 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-20100004284-A1 Novel Heterocyclic Compounds as Positive Allosteric Modulators of Metabotropic Glutamate Receptors GRM5, GRM1, GRIK5 GRM5 1/4885CLPP 4732/4885KMT2A 1414/4885

“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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