SCHEMBL16632924

SCHEMBL16632924

CCCCCC1(CCCCC)c2ccccc2-c2ccc(B(O)c3ccc4c(c3)C(CCCCC)(CCCCC)c3ccccc3-4)cc21

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 7/20 0.39
APEX1 P27695 1/20 0.39
PCSK9 Q8NBP7 1/20 0.34
LIPG Q9Y5X9 7/20 0.33
LPL P06858 6/20 0.33
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33
MMP8 P22894 2/20 0.33
MMP13 P45452 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
MGLL Q99685 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
SCHEMBL16633971 0.99 PDK2 (0.40) PDK2APEX1PCSK9LIPGLPL
SCHEMBL16633883 0.96 APEX1 (0.40) PDK2APEX1PCSK9LIPGLPL
SCHEMBL5502877 0.92 LIPG (0.42) PDK2APEX1PCSK9LIPGLPL
SCHEMBL3789775 0.90 LIPG (0.43) PDK2APEX1PCSK9LIPGLPL
SCHEMBL3194907 0.90 LIPG (0.43) PDK2APEX1PCSK9LIPGLPL
SCHEMBL30800031 0.90 LIPG (0.43) PDK2APEX1PCSK9LIPGLPL
SCHEMBL30274473 0.90 LIPG (0.43) PDK2APEX1PCSK9LIPGLPL
SCHEMBL6234954 0.90 LIPG (0.43) PDK2APEX1PCSK9LIPGLPL
SCHEMBL16632979 0.90 APEX1 (0.41) PDK2APEX1PCSK9
SCHEMBL16872804 0.87 LIPG (0.40) PDK2APEX1PCSK9LIPGLPL

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
EP-2886548-A1 METHOD FOR PRODUCING BORINIC ACID DERIVATIVE, AND NOVEL BORINIC ACID DERIVATIVE Manac Inc. (JP) 2015-06-24 EP disclosed
US-20150105562-A1 METHOD FOR PREPARING BORINIC ACID DERIVATIVES AND NOVEL BORINIC ACID DERIVATIVES MANAC INC. (JP) 2015-04-16 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-20150105562-A1 METHOD FOR PREPARING BORINIC ACID DERIVATIVES AND NOVEL BORINIC ACID DERIVATIVES ADORA2B, TPSAB1, ACVR2B PDK2 2287/4885APEX1 551/4885PCSK9 1420/4885

“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.