SCHEMBL293493

SCHEMBL293493

CCCCN(CC)S(N)(=O)=O

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 15/20 0.58
CA2 P00918 13/20 0.58
CA12 O43570 6/20 0.58
CA14 Q9ULX7 4/20 0.58
CA9 Q16790 10/20 0.39
KDM4E B2RXH2 1/20 0.37
TSHR P16473 1/20 0.37
CA7 P43166 3/20 0.35
CA3 P07451 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
CA5A P35218 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
SERPINE1 P05121 1/20 0.35

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
SCHEMBL392284 0.91 CA2 (0.54) CA1CA2CA12CA14CA9
SCHEMBL293306 0.90 CA1 (0.71) CA1CA2CA12CA14CA9
Methane SCHEMBL8657931 0.88 CA1 (0.68) CA1CA2CA12CA14CA9
SCHEMBL25129256 0.86 CA2 (0.65) CA1CA2CA12CA14CA9
SCHEMBL293342 0.86 CA1 (0.81) CA1CA2CA12CA14CA9
SCHEMBL293003 0.85 CA1 (0.80) CA1CA2CA12CA14CA9
SCHEMBL293336 0.83 CA2 (0.68) CA1CA2CA12CA14CA9
SCHEMBL24248274 0.82 CA1 (0.60) CA1CA2CA12CA14CA9
SCHEMBL15546426 0.81 CA2 (0.65) CA1CA2CA12CA14CA9
SCHEMBL23319282 0.81 CA2 (0.65) CA1CA2CA12CA14CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158790-B2 Cyclic amine compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-04-17 US disclosed
EP-2036896-B1 CYCLIC AMINE COMPOUND DAIICHI SANKYO CO LTD (JP) 2012-03-14 EP disclosed
US-20090286807-A1 CYCLIC AMINE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-11-19 US disclosed
EP-2036896-A1 CYCLIC AMINE COMPOUND Daiichi Sankyo Company, Limited (JP) 2009-03-18 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-20090286807-A1 CYCLIC AMINE COMPOUND HRH3, HRH4, H1-0 CA1 4685/4885CA2 2321/4885CA12 4320/4885

“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.