SCHEMBL3973348

SCHEMBL3973348

O=S(=O)(Nc1ccc(I)cc1)N1CCOCC1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.71
FKBP1A P62942 4/20 0.49
GLA P06280 1/20 0.49
KMT2A Q03164 1/20 0.49
HSD17B10 Q99714 1/20 0.48
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
ALDH1A1 P00352 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
HIF1A Q16665 1/20 0.42
EPAS1 Q99814 1/20 0.42

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
SCHEMBL6613032 0.83 POLB (0.71) POLBFKBP1AGLAKMT2AHSD17B10
SCHEMBL15139607 0.83 POLB (0.71) POLBFKBP1AGLAKMT2AHSD17B10
SCHEMBL1853129 0.83 POLB (0.71) POLBFKBP1AGLAKMT2AHSD17B10
SCHEMBL3369957 0.80 POLB (0.67) POLBFKBP1AGLAKMT2AHSD17B10
SCHEMBL8724983 0.80 POLB (0.70) POLBFKBP1AGLAKMT2AHSD17B10
SCHEMBL3439600 0.80 POLB (0.66) POLBFKBP1AGLAKMT2AHSD17B10
SCHEMBL27830860 0.80 POLB (0.66) POLBKMT2AHSD17B10ALDH1A1L3MBTL1
SCHEMBL10048553 0.80 POLB (0.66) POLBFKBP1AGLAKMT2AALDH1A1
SCHEMBL31634184 0.77 POLB (0.62) POLBKMT2AHSD17B10ALDH1A1HPGD
SCHEMBL11231122 0.76 POLB (1.00) POLBFKBP1AKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100540536-C Phenylpyridylpiperazcompounds compounds, their preparation method and the pharmaceutical composition that comprises them SERVIER LAB (FR) 2009-09-16 CN disclosed
US-7494995-B2 Phenylpyridylpiperazine compounds LES LABORATOIRES SERVIER (FR) 2009-02-24 US disclosed
CN-1896062-A New phenylpyridylpiperazine compounds, a process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2007-01-17 CN disclosed
US-20060258671-A1 Phenylpyridylpiperazine compounds LES LABORATORIES SERVIER (FR) 2006-11-16 US disclosed
EP-1721896-A1 Phenylpyridinylpiperazin derivatives, the process to make them and the 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-20060258671-A1 Phenylpyridylpiperazine compounds HRH4, HRH3, HRH2 POLB 4533/4885FKBP1A 2495/4885GLA 4779/4885

“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.