SCHEMBL11293604

SCHEMBL11293604

CN(C)/C=C1/CCC=C(O[Si](C)(C)C(C)(C)C)C1=O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL2436117 1.00 PREP (0.32) PREPKDM4EMEN1KMT2A
SCHEMBL2436120 1.00 PREP (0.32) PREPKDM4EMEN1KMT2A
SCHEMBL5684885 0.74 PREP (0.36) PREP
SCHEMBL427185 0.74 KMT2A (0.33) KDM4EMEN1KMT2A
SCHEMBL882859 0.74 KMT2A (0.33) KDM4EMEN1KMT2A
SCHEMBL426527 0.74 KMT2A (0.33) KDM4EMEN1KMT2A
SCHEMBL12300710 0.69 MEN1 (0.39) KDM4EMEN1KMT2A
SCHEMBL754295 0.68 PREP (0.34) PREP
SCHEMBL11307712 0.67 MEN1 (0.38) KDM4EMEN1KMT2A
SCHEMBL29860057 0.64 PREP (0.33) PREP

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-8288400-B2 Compositions useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-10-16 US disclosed
US-20120183577-A1 COMPOSITIONS USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-19 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-20120183577-A1 COMPOSITIONS USEFUL AS INHIBITORS OF PROTEIN KINASES MAP3K20, MAP3K1, MAP3K6 PREP 3022/4885KDM4E 2132/4885MEN1 1496/4885

“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.