SCHEMBL4008490

SCHEMBL4008490

O=S(=O)(c1ccc(B(O)O)cc1)N1CCC2(CC1)OCCO2

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.71
KDM4E B2RXH2 1/20 0.71
PKM P14618 1/20 0.59
ALDH1A1 P00352 3/20 0.54
MAPK1 P28482 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
ATM Q13315 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
TP53 P04637 1/20 0.47

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
SCHEMBL6154077 0.83 POLB (1.00) POLBKDM4EPKMALDH1A1MAPK1
SCHEMBL12793323 0.82 KDM4E (0.79) POLBKDM4EPKMALDH1A1MAPK1
SCHEMBL12386397 0.81 KDM4E (0.77) POLBKDM4EPKMALDH1A1MAPK1
SCHEMBL2080837 0.81 KDM4E (0.77) POLBKDM4EPKMALDH1A1MAPK1
SCHEMBL4009309 0.81 KDM4E (0.77) POLBKDM4EPKMALDH1A1MAPK1
SCHEMBL2831202 0.81 KDM4E (0.77) POLBKDM4EPKMALDH1A1MAPK1
SCHEMBL4009686 0.81 CYP2D6 (0.49) POLBKDM4EPKMALDH1A1MAPK1
SCHEMBL5306415 0.81 POLB (1.00) POLBKDM4EPKMALDH1A1SMN1; SMN2
SCHEMBL144421 0.80 POLB (0.67) POLBKDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL289460 0.78 USP2 (0.62) POLBPKMALDH1A1SMN1; SMN2LMNA

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
US-7494994-B2 Phenylpyridylpiperazine compounds LES LABORATOIRES SERVIER (FR) 2009-02-24 US disclosed
US-20060258670-A1 New phenylpyridylpiperazine compounds LES LABORATOIRES SERVIER (FR) 2006-11-16 US disclosed
EP-1721897-A1 Phenylpyridinylpiperazin derivatives, the process to make them and the pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2006-11-15 EP 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-20060258670-A1 New phenylpyridylpiperazine compounds HRH4, HRH3, HRH2 POLB 4224/4885KDM4E 2057/4885PKM 3187/4885

“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.