SCHEMBL2829665

SCHEMBL2829665

CCN1CCN(c2ccc(NS(=O)(=O)N(C)C)cn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.53
KDM4E B2RXH2 3/20 0.53
KMT2A Q03164 3/20 0.47
POLB P06746 1/20 0.45
MEN1 O00255 2/20 0.45
HPGD P15428 3/20 0.43
HSD17B10 Q99714 1/20 0.41
SYK P43405 2/20 0.41
MET P08581 1/20 0.41
HRH3 Q9Y5N1 2/20 0.40
ZAP70 P43403 1/20 0.40
FGFR3 P22607 1/20 0.40
JAK2 O60674 1/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL2829135 0.82 GAA (0.49) GAAKDM4EKMT2AMEN1HPGD
SCHEMBL7485653 0.82 ALOX12 (0.50) GAAKDM4EKMT2APOLBMEN1
SCHEMBL2829674 0.81 KDM4E (0.51) GAAKDM4EHSD17B10SYKHRH3
SCHEMBL2824378 0.80 GAA (0.49) GAAKDM4EKMT2AMEN1HSD17B10
SCHEMBL15183915 0.78 KDM4E (0.52) GAAKDM4EKMT2ASYKHRH3
SCHEMBL7494810 0.78 ALOX12 (0.47) GAAKDM4EKMT2AMEN1HSD17B10
SCHEMBL15061265 0.77 KMT2A (0.61) GAAKDM4EKMT2APOLBMEN1
Hydrochloric Acid SCHEMBL4690768 0.76 KMT2A (0.60) GAAKDM4EKMT2AMEN1
SCHEMBL15179045 0.76 KDM4E (0.50) GAAKDM4ESYKHRH3ZAP70
SCHEMBL1126180 0.74 KDM1A (0.50) GAAKDM4EPOLBSYKHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1824829-B1 3-SUBSTITUTED PYRIDINE DERIVATIVES AS H3 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2010-05-05 EP claimed
EP-1824829-A1 3-SUBSTITUTED PYRIDINE DERIVATIVES AS H3 ANTAGONISTS F. Hoffmann-Roche AG (CH) 2007-08-29 EP claimed
US-20060122187-A1 Pyridine derivatives as H3 antagonists F. HOFFMANN-LA ROCHE AG (CH) 2006-06-08 US claimed
WO-2006058649-A1 3-SUBSTITUTED PYRIDINE DERIVATIVES AS H3 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-06-08 WO claimed
US-7528135-B2 Pyridine derivatives as H3 antagonists HOFFMANN-LA ROCHE INC. (US) 2009-05-05 US disclosed
EP-1824829-A1 3-SUBSTITUTED PYRIDINE DERIVATIVES AS H3 ANTAGONISTS F. Hoffmann-Roche AG (CH) 2007-08-29 EP disclosed
US-20060122187-A1 Pyridine derivatives as H3 antagonists F. HOFFMANN-LA ROCHE AG (CH) 2006-06-08 US disclosed
WO-2006058649-A1 3-SUBSTITUTED PYRIDINE DERIVATIVES AS H3 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-06-08 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-20060122187-A1 Pyridine derivatives as H3 antagonists HRH3, HRH4, HRH2 GAA 2915/4885KDM4E 437/4885KMT2A 164/4885

“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.