SCHEMBL5165604

SCHEMBL5165604

CC1(C)COC(c2cccc(B(Oc3cccc4cccnc34)c3cccc(Cl)c3)c2)=N1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.36
HPGD P15428 4/20 0.35
HRH3 Q9Y5N1 1/20 0.35
LMNA P02545 4/20 0.34
MAPT P10636 4/20 0.34
HTT P42858 3/20 0.34
ALDH1A1 P00352 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SLC40A1 Q9NP59 1/20 0.34
ROCK1 Q13464 1/20 0.34
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL5166381 0.94 KDM4E (0.40) KDM4EHPGDHRH3LMNAMAPT
SCHEMBL25243696 0.89 HRH3 (0.37) KDM4EHRH3LMNAMAPTHTT
SCHEMBL30571008 0.89 HRH3 (0.37) KDM4EHRH3LMNAMAPTHTT
SCHEMBL5167306 0.82 KDM4E (0.36) KDM4EHPGDHRH3LMNAMAPT
SCHEMBL4168555 0.81 LMNA (0.47) KDM4EHPGDLMNAMAPTHTT
SCHEMBL5165520 0.75 HPGD (0.45) KDM4EHPGDHRH3LMNAMAPT
SCHEMBL5167718 0.74 RAB9A (0.44) KDM4EHPGDLMNAMAPTHTT
SCHEMBL5166506 0.74 RAB9A (0.47) KDM4EHPGDLMNAMAPTHTT
SCHEMBL4830698 0.74 MEN1 (0.44) KDM4EHPGDLMNAMAPTHTT
SCHEMBL8491691 0.73 HPGD (0.55) KDM4EHPGDHRH3LMNAMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1771182-A1 ANTI-PARASITIC USES OF BORINIC ACID COMPLEXES Anacor Pharmaceuticals, Inc. (US) 2007-04-11 EP disclosed
US-20060014723-A1 Anti-parasitic uses of borinic acid complexes ANACOR PHARMACEUTICALS, INC. 2006-01-19 US disclosed
WO-2005123095-A1 ANTI-PARASITIC USES OF BORINIC ACID COMPLEXES ANACOR PHARMACEUTICALS, INC. (US) 2005-12-29 WO 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-20060014723-A1 Anti-parasitic uses of borinic acid complexes BPGM, HRH1, HRH3 KDM4E 4785/4885HPGD 304/4885HRH3 3/4885

“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.