SCHEMBL838445

SCHEMBL838445

CC(C)(C)[Si](OCCOCC(O)C(=O)Nc1ccc(Cl)cn1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
LMNA P02545 4/20 0.43
TSHR P16473 2/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
HTT P42858 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
RAB9A P51151 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL838444 1.00 TDP1 (0.43) TDP1LMNATSHRL3MBTL1HTT
SCHEMBL838731 0.89 RAB9A (0.40) LMNAL3MBTL1RAB9AALDH1A1KDM4E
SCHEMBL838730 0.89 RAB9A (0.40) LMNAL3MBTL1RAB9AALDH1A1KDM4E
SCHEMBL839689 0.89 FFAR2 (0.38) TDP1HTTRAB9AMAPK1ALDH1A1
SCHEMBL839688 0.89 FFAR2 (0.38) TDP1HTTRAB9AMAPK1ALDH1A1
SCHEMBL839957 0.86 ALDH1A1 (0.44) LMNARAB9AALDH1A1KDM4E
SCHEMBL839958 0.86 ALDH1A1 (0.44) LMNARAB9AALDH1A1KDM4E
SCHEMBL838905 0.86 GCK (0.38) MEN1KMT2A
SCHEMBL838904 0.86 GCK (0.38) MEN1KMT2A
SCHEMBL838897 0.80 CYP3A4 (0.38) HTTALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
EP-2324028-A2 THERAPEUTIC AGENTS 414 AstraZeneca AB (SE) 2011-05-25 EP disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
WO-2010015849-A2 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-02-11 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-20100093757-A1 THERAPEUTIC AGENTS 414 GCK, GCKR, GPR119 TDP1 3683/4885LMNA 3530/4885TSHR 1264/4885

“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.