SCHEMBL21068488

SCHEMBL21068488

CCOC(=O)COCCC(C)(C)CCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.32
MGAM O43451 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
TSHR P16473 2/20 0.32
DRD2 P14416 1/20 0.31
TRPA1 O75762 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CA12 O43570 1/20 0.30
CA9 Q16790 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
SCHEMBL7698520 0.82 CYP1A2 (0.41) GAAMGAMSIMGAM2TSHR
SCHEMBL28436718 0.81 DUT (0.32)
SCHEMBL21069035 0.80 CYP4F2 (0.38) GAAMGAMSIMGAM2TSHR
SCHEMBL6220404 0.79 GAA (0.43) GAAMGAMSIMGAM2TSHR
SCHEMBL16820981 0.76 CYP1A2 (0.41) GAAMGAMSIMGAM2TSHR
SCHEMBL19917367 0.74 GAA (0.41) GAAMGAMSIMGAM2TSHR
SCHEMBL31651588 0.73 CYP1A2 (0.47) GAAMGAMSIMGAM2TSHR
SCHEMBL29132502 0.73 LMNA (0.37) TSHR
SCHEMBL14498357 0.72 GAA (0.41) GAAMGAMSIMGAM2TSHR
SCHEMBL7698911 0.71 MAPT (0.38) ALDH1A1CA12CA9

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
EP-3727355-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER AstraZeneca AB (SE) 2020-10-28 EP disclosed
CN-111491623-A Compounds and their use in the treatment of cancer 阿斯利康(瑞典)有限公司 2020-08-04 CN disclosed
US-20190194190-A1 Compounds and Their Use in Treating Cancer ASTRAZENECA PHARMACEUTICALS LP 2019-06-27 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-20190194190-A1 Compounds and Their Use in Treating Cancer F12, CCNY, CCNE1 GAA 490/4885MGAM 2541/4885SI 404/4885

“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.