SCHEMBL103367

SCHEMBL103367

Fc1cccc(C#CCCc2nc3ccccc3s2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UBE2T Q9NPD8 1/20 0.43
ASIC3 Q9UHC3 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 1/20 0.42
PDE10A Q9Y233 1/20 0.42
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 3/20 0.40
GRM5 P41594 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
PTGS1 P23219 2/20 0.39
PTGS2 P35354 2/20 0.39
HTR1A P08908 1/20 0.39

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
SCHEMBL101888 0.85 PDE10A (0.43) UBE2TASIC3L3MBTL1KMT2AMEN1
SCHEMBL103079 0.85 GRM5 (0.59) UBE2TASIC3KMT2AMEN1TDP1
SCHEMBL103658 0.85 UBE2T (0.43) UBE2TASIC3L3MBTL1TDP1SMN1; SMN2
SCHEMBL102774 0.82 RAB9A (0.52) UBE2TASIC3L3MBTL1SMN1; SMN2ALOX15
SCHEMBL101855 0.80 SMN1; SMN2 (0.48) UBE2TASIC3L3MBTL1KMT2AMEN1
SCHEMBL103069 0.76 HPGD (0.46) UBE2TASIC3L3MBTL1TDP1SMN1; SMN2
SCHEMBL103042 0.75 DRD2 (0.43) UBE2TASIC3L3MBTL1TDP1SMN1; SMN2
SCHEMBL103429 0.74 GRM5 (0.50) KMT2ATDP1SMN1; SMN2HTTPDE10A
SCHEMBL101447 0.72 GRM5 (0.46) L3MBTL1KMT2AMEN1SMN1; SMN2PDE10A
SCHEMBL19372016 0.72 UBE2T (0.70) UBE2TASIC3L3MBTL1TDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2426115-A2 Alkynyl derivatives as modulators of metabotropic glutamate receptors Addex Pharma SA (CH) 2012-03-07 EP claimed
US-20090124625-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METATROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2009-05-14 US claimed
US-8883826-B2 Alkynyl derivatives as modulators of metabotropic glutamate receptors ADDEX PHARMA SA (CH) 2014-11-11 US disclosed
US-8674106-B2 Alkynyl derivatives as modulators of metabotropic glutamate receptors ADDEX PHARMA SA (CH) 2014-03-18 US disclosed
US-20130178631-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2013-07-11 US disclosed
US-20120277237-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2012-11-01 US disclosed
EP-2426115-A2 Alkynyl derivatives as modulators of metabotropic glutamate receptors Addex Pharma SA (CH) 2012-03-07 EP disclosed
US-8101637-B2 Alkynyl derivatives as modulators of metatropic glutamate receptors ADDEX PHARMA SA (CH) 2012-01-24 US disclosed
US-20090124625-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METATROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2009-05-14 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 (3 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-20130178631-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRM5, GRM1, GRM2 UBE2T 3494/4885ASIC3 352/4885L3MBTL1 3907/4885
US-20090124625-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METATROPIC GLUTAMATE RECEPTORS GRM5, GRM2, GRM1 UBE2T 3293/4885ASIC3 451/4885L3MBTL1 4070/4885
US-20120277237-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRM5, GRM1, GRM2 UBE2T 3494/4885ASIC3 352/4885L3MBTL1 3907/4885

“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.