Sugi Predict

Sugi Predict / Compounds / SCHEMBL8506745

SCHEMBL8506745

SCHEMBL8506745

CC(C)(C)[Si](OC(O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C1CCC(=O)O1)(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SMYD2 Q9NRG4 2/20 0.34
▸ CYP3A4 P08684 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CA1 P00915 1/20 0.30
▸ CA9 Q16790 1/20 0.30
▸ BACE1 P56817 1/20 0.30
▸ PRKCA P17252 3/20 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
SCHEMBL17904279 0.88 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL17822610 0.86 PRKCA (0.37) SMYD2CYP3A4HTTSMN1; SMN2PRKCA
SCHEMBL17822574 0.86 PRKCA (0.37) SMYD2CYP3A4HTTSMN1; SMN2PRKCA
SCHEMBL17822499 0.86 PRKCA (0.37) SMYD2CYP3A4HTTSMN1; SMN2PRKCA
SCHEMBL2963838 0.75 CA1 (0.31) CA1CA9PRKCA
SCHEMBL598237 0.75 CA1 (0.31) CA1CA9PRKCA
SCHEMBL2963840 0.75 CA1 (0.31) CA1CA9PRKCA
SCHEMBL598238 0.75 CA1 (0.31) CA1CA9PRKCA
SCHEMBL598239 0.75 CA1 (0.31) CA1CA9PRKCA
SCHEMBL1739798 0.74 SMYD2 (0.41) SMYD2CYP3A4HTTSMN1; SMN2CA1

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-5874464-A ANTAGONIST OF PROTEIN KINASE C THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1999-02-23 — — US disclosed