SCHEMBL5166277

SCHEMBL5166277

Cc1ccc(B(Oc2cccc3cccnc23)c2ccccc2)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.52
GAA P10253 2/20 0.52
ALDH1A1 P00352 2/20 0.52
POLB P06746 1/20 0.52
KDM4E B2RXH2 8/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPK1 P28482 2/20 0.47
MAPT P10636 8/20 0.46
LMNA P02545 5/20 0.46
HPGD P15428 3/20 0.46
HTT P42858 2/20 0.46
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
TP53 P04637 1/20 0.42
METAP2 P50579 2/20 0.41

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
SCHEMBL4169797 0.83 METAP2 (0.55) NPSR1POLBKDM4EMEN1KMT2A
SCHEMBL4835873 0.81 RAB9A (0.45) NPSR1GAAALDH1A1POLBKDM4E
SCHEMBL5167091 0.81 ALDH1A1 (0.46) NPSR1GAAALDH1A1POLBKDM4E
SCHEMBL4168555 0.80 LMNA (0.47) NPSR1GAAALDH1A1POLBKDM4E
SCHEMBL4169850 0.80 LMNA (0.51) NPSR1GAAALDH1A1POLBKDM4E
SCHEMBL5166054 0.79 GAA (0.50) NPSR1GAAALDH1A1POLBKDM4E
SCHEMBL5165576 0.79 RAB9A (0.42) NPSR1GAAALDH1A1POLBKDM4E
SCHEMBL5166506 0.79 RAB9A (0.47) NPSR1GAAALDH1A1POLBKDM4E
SCHEMBL5166117 0.78 GAA (0.49) NPSR1GAAALDH1A1POLBKDM4E
SCHEMBL12260632 0.78 RAB9A (0.52) ALDH1A1KDM4EMEN1KMT2AMAPT

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 NPSR1 1237/4885GAA 325/4885ALDH1A1 2879/4885

“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.