SCHEMBL4735342

SCHEMBL4735342

C[Si](C)(C)c1ccc(C#Cc2cccc(Br)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 7/20 0.48
ALDH1A1 P00352 2/20 0.36
MAPK1 P28482 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
ASIC3 Q9UHC3 1/20 0.33
APP P05067 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 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
SCHEMBL4737005 0.87 GRM5 (0.49) GRM5ALDH1A1MAPK1KDM4EMEN1
SCHEMBL29779956 0.80 GRM5 (0.53) GRM5ALDH1A1MAPK1CA12CA1
SCHEMBL1375869 0.80 GRM5 (0.53) GRM5ALDH1A1MAPK1CA12CA1
SCHEMBL15780711 0.79 CA12 (0.53) GRM5ALDH1A1MAPK1CA12CA1
SCHEMBL456129 0.78 APP (0.57) GRM5ALDH1A1CA12CA1CA2
SCHEMBL8000068 0.78 APP (0.57) GRM5ALDH1A1MAPK1CA12CA1
SCHEMBL29825848 0.78 APP (0.57) GRM5ALDH1A1MAPK1CA12CA1
SCHEMBL4516451 0.76 APP (0.47) GRM5ALDH1A1MAPK1CA12CA1
SCHEMBL4312379 0.76 GRM5 (0.47) GRM5APPNPC1RAB9A
SCHEMBL2795902 0.76 GRM5 (0.47) GRM5ALDH1A1MAPK1KDM4EMEN1

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.