SCHEMBL3757198

SCHEMBL3757198

CC(C)(C)[Si](C)(C)OCCCCNC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DUT P33316 1/20 0.35
CA12 O43570 3/20 0.35
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 3/20 0.35
TDP1 Q9NUW8 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.33
ACHE P22303 6/20 0.33
KDM4E B2RXH2 2/20 0.32
MAPK1 P28482 1/20 0.32
HIF1A Q16665 1/20 0.32
CASP2 P42575 1/20 0.31

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
SCHEMBL22774011 0.98 TDP1 (0.37) DUTCA12CA1CA2CA9
SCHEMBL2551625 0.98 TDP1 (0.37) DUTCA12CA1CA2CA9
SCHEMBL2877636 0.95 DUT (0.36) DUTTDP1POLBHPGDTSHR
SCHEMBL27160920 0.92 EPHX2 (0.33) DUTCA12CA1CA2CA9
SCHEMBL15941254 0.87 BACE1 (0.32) DUT
SCHEMBL23860073 0.87 EPHX2 (0.34) DUTMEN1KMT2AGAA
SCHEMBL27160300 0.87 GAA (0.34) DUTHPGDTSHRRAB9AMEN1
SCHEMBL5623734 0.85 MAOA (0.36) DUTCA12CA1CA2CA9
SCHEMBL27160301 0.84 MEN1 (0.37) DUTMEN1KMT2AGAAKDM4E
SCHEMBL13451785 0.82 TDP1 (0.57) CA12CA1CA2CA9TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias ASTRAZENECA AB (SE) 2010-11-25 US disclosed
US-20080015237-A1 NEW COMPOUNDS I/418 ASTRAZENECA AB (SE) 2008-01-17 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 (2 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-20080015237-A1 NEW COMPOUNDS I/418 KCNH1, KCNH2, KCNH3 DUT 2853/4885CA12 2759/4885CA1 1220/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 DUT 1596/4885CA12 4828/4885CA1 3620/4885

“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.