SCHEMBL4645880

SCHEMBL4645880

O=C(c1cccc(F)c1)N1CCCC(c2nc(Oc3ccccc3)no2)C1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.68
▸ RAB9A P51151 3/20 0.65
▸ HSD11B1 P28845 3/20 0.58
▸ ALDH1A1 P00352 2/20 0.54
▸ GAA P10253 1/20 0.54
▸ POLB P06746 1/20 0.54
▸ GRM5 P41594 4/20 0.53
▸ CLPP Q16740 1/20 0.53
▸ NPC1 O15118 2/20 0.52
▸ TP53 P04637 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51

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
SCHEMBL4645872 1.00 L3MBTL1 (0.68) L3MBTL1RAB9AHSD11B1ALDH1A1GAA
SCHEMBL3137416 0.95 L3MBTL1 (0.69) L3MBTL1RAB9AHSD11B1ALDH1A1GAA
SCHEMBL3137399 0.95 L3MBTL1 (0.69) L3MBTL1RAB9AHSD11B1ALDH1A1GAA
SCHEMBL3130199 0.94 L3MBTL1 (0.63) L3MBTL1RAB9AHSD11B1ALDH1A1GAA
SCHEMBL3130211 0.94 L3MBTL1 (0.63) L3MBTL1RAB9AHSD11B1ALDH1A1GAA
SCHEMBL3141460 0.93 L3MBTL1 (0.58) L3MBTL1RAB9AHSD11B1ALDH1A1POLB
SCHEMBL3141476 0.93 L3MBTL1 (0.58) L3MBTL1RAB9AHSD11B1ALDH1A1POLB
SCHEMBL4649009 0.91 L3MBTL1 (0.58) L3MBTL1RAB9AHSD11B1ALDH1A1GAA
SCHEMBL3141179 0.91 L3MBTL1 (0.63) L3MBTL1RAB9AHSD11B1ALDH1A1GAA
SCHEMBL3141171 0.91 L3MBTL1 (0.63) L3MBTL1RAB9AHSD11B1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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