SCHEMBL9907301

SCHEMBL9907301

C=CCCCCC[C@H](NC(=O)OCC[Si](C)(C)C)C(=O)N1C[C@H](NC(=O)OC(C)(C)C)C[C@H]1C(=O)N[C@]1(C(=O)OCC)C[C@H]1C=C

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.33
HDAC8 Q9BY41 1/20 0.33
CYP3A4 P08684 1/20 0.33
HDAC4 P56524 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
SCHEMBL330520 0.91 HDAC8 (0.37) HDAC1HDAC8CYP3A4HDAC4
SCHEMBL330519 0.91 HDAC8 (0.37) HDAC1HDAC8CYP3A4HDAC4
SCHEMBL3674630 0.84 HDAC1 (0.39) HDAC1HDAC8CYP3A4HDAC4
SCHEMBL1943013 0.84 HDAC1 (0.39) HDAC1HDAC8CYP3A4HDAC4
SCHEMBL13610589 0.84 HDAC1 (0.37) HDAC1HDAC8CYP3A4HDAC4
SCHEMBL10254350 0.84 HDAC1 (0.39) HDAC1HDAC8CYP3A4HDAC4
SCHEMBL17676680 0.84 HDAC1 (0.39) HDAC1HDAC8CYP3A4HDAC4
SCHEMBL15747003 0.84 HDAC1 (0.39) HDAC1HDAC8CYP3A4HDAC4
SCHEMBL13783718 0.84 HDAC1 (0.39) HDAC1HDAC8CYP3A4HDAC4
SCHEMBL8026867 0.84 HDAC1 (0.39) HDAC1HDAC8CYP3A4HDAC4

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-20120141414-A1 Bimacrocylic HCV NS3 Protease Inhibitors SEQUOIA PHARMACEUTICALS, INC. (US) 2012-06-07 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-20120141414-A1 Bimacrocylic HCV NS3 Protease Inhibitors HAVCR2, CTRC, CTSC HDAC1 1450/4885HDAC8 2469/4885CYP3A4 544/4885

“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.