SCHEMBL5485424

SCHEMBL5485424

C[C@@H]1CN(c2ncc(F)cc2C#N)CCN1C(=O)/C=C/c1cccc(OC(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIT P10721 6/20 0.44
GRM1 Q13255 1/20 0.39
PIK3CD O00329 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CHRM1 P11229 9/20 0.38
CHRM2 P08172 2/20 0.38
CHRM4 P08173 2/20 0.38
CHRM3 P20309 2/20 0.38
KDM4E B2RXH2 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL5485428 1.00 KIT (0.44) KITGRM1PIK3CDL3MBTL1CHRM1
SCHEMBL5482960 0.89 GRM1 (0.51) KITGRM1PIK3CDL3MBTL1KDM4E
SCHEMBL5482964 0.89 GRM1 (0.51) KITGRM1PIK3CDL3MBTL1KDM4E
SCHEMBL5486552 0.88 GRM1 (0.42) KITGRM1PIK3CDL3MBTL1CHRM1
SCHEMBL5480673 0.88 CHRM1 (0.42) KITGRM1PIK3CDL3MBTL1CHRM1
SCHEMBL5486546 0.88 GRM1 (0.42) KITGRM1PIK3CDL3MBTL1CHRM1
SCHEMBL5480665 0.88 CHRM1 (0.42) KITGRM1PIK3CDL3MBTL1CHRM1
SCHEMBL5481574 0.87 CHRM1 (0.42) KITGRM1L3MBTL1CHRM1CHRM2
SCHEMBL5481568 0.87 CHRM1 (0.42) KITGRM1L3MBTL1CHRM1CHRM2
SCHEMBL5484705 0.85 KIT (0.44) KITGRM1PIK3CDL3MBTL1KDM4E

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-20070049578-A1 Cinnamamide compounds as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-03-01 US claimed
US-20070049578-A1 Cinnamamide compounds as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-03-01 US disclosed
US-20070049578-A1 Cinnamamide compounds as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-03-01 US disclosed
US-20070049578-A1 Cinnamamide compounds as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-03-01 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 (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-20070049578-A1 Cinnamamide compounds as metabotropic glutamate receptor antagonists GRM5, GRM1, GRM3 KIT 2227/4885GRM1 2/4885PIK3CD 2711/4885

“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.