SCHEMBL5438501

SCHEMBL5438501

CC(C)(C)[SiH2]OC(C)(C)c1ccc2cc(C(=O)NN)ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MAPT P10636 6/20 0.42
NPC1 O15118 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC6 Q9UBN7 1/20 0.38
PTPN1 P18031 1/20 0.38
CYP3A4 P08684 3/20 0.38
MPO P05164 1/20 0.38
KDM5A P29375 1/20 0.38
BLM P54132 1/20 0.38
GFER P55789 1/20 0.38
PMP22 Q01453 1/20 0.38
HIF1A Q16665 1/20 0.38
ALDH1A1 P00352 5/20 0.38
PLAU P00749 1/20 0.38
CYP17A1 P05093 2/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL5449161 0.84 PTPN11 (0.46) CA1CA2MAPTNPC1CYP3A4
SCHEMBL808434 0.74 MPO (0.58) CA1CA2MAPTNPC1CYP3A4
SCHEMBL14920105 0.71 MAPT (0.47) CA1CA2MAPTNPC1MEN1
SCHEMBL4189157 0.70 MAPT (0.70) CA1CA2MAPTALDH1A1PLAU
SCHEMBL5693970 0.69 CA1 (0.71) CA1CA2MAPTNPC1ALDH1A1
SCHEMBL9648378 0.69 MPO (0.56) CA1CA2MAPTNPC1CYP3A4
SCHEMBL18951239 0.69 CYP2A6 (0.55) CA1CA2MAPTNPC1CYP3A4
SCHEMBL12571872 0.69 OGG1 (0.66) CA1CA2MAPTNPC1MEN1
SCHEMBL21241276 0.68 PLAU (0.62) CA1CA2MAPTNPC1CYP3A4
SCHEMBL1149678 0.68 NPC1 (0.62) MAPTNPC1MEN1KMT2AHDAC6

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-20070135485-A1 Novel mch receptor antagonists ELI LILLY AND COMPANY 2007-06-14 US disclosed
EP-1723126-A2 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2006-11-22 EP disclosed
WO-2005040157-A2 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2005-05-06 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-20070135485-A1 Novel mch receptor antagonists MCHR1, MCHR2, MC1R CA1 4381/4885CA2 1917/4885MAPT 1496/4885

“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.