SCHEMBL13311318

SCHEMBL13311318

CC(C)(C)OC(=O)COCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 2/20 0.35
CYP3A4 P08684 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TLR2 O60603 1/20 0.35
TLR1 Q15399 1/20 0.35
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
PTPN1 P18031 1/20 0.34
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
PTPRC P08575 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL29386513 0.88 TLR2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2TLR2
SCHEMBL22557768 0.86 SMN1; SMN2 (0.38) SMYD2CYP3A4HTTSMN1; SMN2KDM4E
SCHEMBL13311307 0.86 SMYD2 (0.38) SMYD2CYP3A4HTTSMN1; SMN2KMT2A
SCHEMBL8071091 0.85 SMN1; SMN2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2KMT2A
SCHEMBL8070836 0.85 SMN1; SMN2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2KMT2A
SCHEMBL12192745 0.82 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2KDM4E
SCHEMBL13311353 0.82 SMYD2 (0.33) SMYD2CYP3A4HTTSMN1; SMN2KDM4E
SCHEMBL14315531 0.81 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2KDM4E
SCHEMBL28950788 0.81 L3MBTL1 (0.37) SMYD2CYP3A4HTTSMN1; SMN2TLR2
SCHEMBL14296503 0.80 CYP3A4 (0.34) SMYD2CYP3A4HTTSMN1; SMN2PTPN1

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
WO-2024071371-A1 HETEROCYCLIC COMPOUND ユビエンス株式会社 2024-04-04 WO disclosed
US-20100137188-A1 FORMULATIONS COMPRISING CYCLIC COMPOUNDS CAPSUGEL BELGIUM (BE) 2010-06-03 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-20100137188-A1 FORMULATIONS COMPRISING CYCLIC COMPOUNDS SLC2A1, SLC2A4, SLC2A9 SMYD2 379/4885CYP3A4 3013/4885HTT 3169/4885

“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.