SCHEMBL3127749

SCHEMBL3127749

O=C(c1ccc(Cl)c(Cl)c1)N1CCCC(c2nc(Oc3cccc(F)c3)no2)C1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.59
▸ RAB9A P51151 2/20 0.56
▸ GRM5 P41594 4/20 0.52
▸ CLPP Q16740 1/20 0.52
▸ HSD11B1 P28845 3/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ ATM Q13315 1/20 0.49
▸ POLB P06746 1/20 0.48

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
SCHEMBL3127733 1.00 L3MBTL1 (0.59) L3MBTL1RAB9AGRM5CLPPHSD11B1
SCHEMBL3145575 0.91 HSD11B1 (0.60) L3MBTL1RAB9AGRM5CLPPHSD11B1
SCHEMBL3145568 0.91 HSD11B1 (0.60) L3MBTL1RAB9AGRM5CLPPHSD11B1
SCHEMBL3137416 0.91 L3MBTL1 (0.69) L3MBTL1RAB9AGRM5CLPPHSD11B1
SCHEMBL3137399 0.91 L3MBTL1 (0.69) L3MBTL1RAB9AGRM5CLPPHSD11B1
SCHEMBL3146200 0.90 GRM5 (0.63) L3MBTL1RAB9AGRM5CLPPHSD11B1
SCHEMBL3138077 0.90 HSD11B1 (0.58) L3MBTL1RAB9AGRM5CLPPHSD11B1
SCHEMBL3140639 0.90 GRM5 (0.63) L3MBTL1RAB9AGRM5CLPPHSD11B1
SCHEMBL3138067 0.90 HSD11B1 (0.58) L3MBTL1RAB9AGRM5CLPPHSD11B1
SCHEMBL3141179 0.89 L3MBTL1 (0.63) L3MBTL1RAB9AGRM5CLPPHSD11B1

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 1 patent. 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

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 L3MBTL1 3297/4885RAB9A 1083/4885GRM5 1/4885

“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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