SCHEMBL3056971

SCHEMBL3056971

CC(=O)OCc1cc(CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)c(N2C[C@@H](C)O[C@@H](C)C2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SCN9A Q15858 1/20 0.32
SMYD2 Q9NRG4 2/20 0.32
MAPK1 P28482 3/20 0.31
LRRK2 Q5S007 1/20 0.31
RAB9A P51151 2/20 0.30
PKM P14618 1/20 0.30
FKBP1A P62942 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL3068264 0.88 ALDH1A1 (0.35) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL2307642 0.88 LRRK2 (0.34) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL5053849 0.87 RORC (0.33) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL5015624 0.86 ALDH1A1 (0.32) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL5014338 0.86 KDM4E (0.36) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL3062273 0.86 KDM4E (0.36) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL2310267 0.86 ALDH1A1 (0.34) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL5014410 0.86 ALDH1A1 (0.34) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL5069831 0.86 ALDH1A1 (0.31) ALDH1A1MEN1KMT2AGAASMYD2
SCHEMBL2307647 0.86 ALDH1A1 (0.31) ALDH1A1MEN1KMT2AGAASMYD2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100261719-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2010-10-14 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-20100261719-A1 CHEMICAL COMPOUNDS NCOA3, NR4A3, NR0B2 ALDH1A1 2604/4885MEN1 1245/4885KMT2A 1391/4885

“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.