SCHEMBL5482402

SCHEMBL5482402

C=CC(=O)N1CCN(c2ncccc2C#N)C[C@H]1C

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 5/20 0.66
KDM4E B2RXH2 4/20 0.50
RECQL P46063 1/20 0.50
ALDH1A1 P00352 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
HSD11B1 P28845 2/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.45
PANK3 Q9H999 1/20 0.45
TRPV1 Q8NER1 2/20 0.43
HDAC2 Q92769 1/20 0.43
ACKR3 P25106 1/20 0.42
SMO Q99835 1/20 0.42
DPP4 P27487 1/20 0.42
PREP P48147 1/20 0.42
DPP8 Q6V1X1 1/20 0.42
DPP9 Q86TI2 1/20 0.42
DPP7 Q9UHL4 1/20 0.42

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
SCHEMBL5480694 0.83 GRM1 (0.56) GRM1KDM4ERECQLALDH1A1TDP1
SCHEMBL5480698 0.83 GRM1 (0.56) GRM1KDM4ERECQLALDH1A1TDP1
SCHEMBL14566007 0.81 KDM4E (0.62) GRM1KDM4ERECQLALDH1A1TDP1
SCHEMBL5477272 0.81 GRM1 (0.56) GRM1KDM4ERECQLALDH1A1TDP1
SCHEMBL5477268 0.81 GRM1 (0.56) GRM1KDM4ERECQLALDH1A1TDP1
SCHEMBL5482307 0.80 GRM1 (0.55) GRM1KDM4ERECQLALDH1A1TDP1
SCHEMBL5487116 0.80 GRM1 (0.55) GRM1KDM4ERECQLALDH1A1TDP1
SCHEMBL5485812 0.80 GRM1 (0.55) GRM1KDM4ERECQLALDH1A1TDP1
SCHEMBL5482304 0.80 GRM1 (0.55) GRM1KDM4ERECQLALDH1A1TDP1
SCHEMBL5487124 0.80 GRM1 (0.55) GRM1KDM4ERECQLALDH1A1TDP1

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 3 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 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 GRM1 2/4885KDM4E 1679/4885RECQL 2826/4885

“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.