SCHEMBL4737005

SCHEMBL4737005

C[Si](C)(C)c1cccc(C#Cc2cccc(Br)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 5/20 0.49
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
ACHE P22303 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL6274089 0.88 GRM5 (0.42) GRM5ACHE
SCHEMBL4735342 0.87 GRM5 (0.48) GRM5ALDH1A1MAPK1NPC1RAB9A
SCHEMBL1086629 0.82 APP (0.50) GRM5ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29945235 0.82 ALDH1A1 (0.48) ALDH1A1MAPK1ACHENPC1RAB9A
SCHEMBL783254 0.82 ALDH1A1 (0.48) ALDH1A1MAPK1ACHENPC1RAB9A
SCHEMBL1375869 0.82 GRM5 (0.53) GRM5ALDH1A1MAPK1
SCHEMBL29779956 0.82 GRM5 (0.53) GRM5ALDH1A1MAPK1
SCHEMBL9390799 0.81 ACHE (0.36) GRM5ACHE
SCHEMBL10928549 0.80 ALDH1A1 (0.46) ALDH1A1MAPK1ACHENPC1RAB9A
SCHEMBL2795902 0.77 GRM5 (0.47) GRM5ALDH1A1MAPK1NPC1RAB9A

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-20080161269-A1 Compounds 620 ASTRAZENECA AB (SE) 2008-07-03 US disclosed
US-20080161269-A1 Compounds 620 ASTRAZENECA AB (SE) 2008-07-03 US disclosed
WO-2008076045-A1 NOVEL 2-AMINO- 5-ARYL-IMIDAZOL-4 -ONES ASTRAZENECA AB (SE) 2008-06-26 WO 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-20080161269-A1 Compounds 620 MAPT, PSEN1, PSEN2 GRM5 54/4885ALDH1A1 2027/4885MAPK1 168/4885

“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.