SCHEMBL2111886

SCHEMBL2111886

[O]S(=O)(=O)CC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ADH4 P08319 1/20 0.32
ADH7 P40394 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA7 P43166 1/20 0.31
CA14 Q9ULX7 1/20 0.31
METAP1 P53582 1/20 0.30
KDM4E B2RXH2 1/20 0.30
RECQL P46063 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL9623360 0.79 CHRM5 (0.36) ADH1BADH1CADH1AADH4ADH7
SCHEMBL600653 0.74 ADH1B (0.31) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1795363 0.74 ADH1B (0.31) ADH1BADH1CADH1AADH4ADH7
SCHEMBL246739 0.74 INPP5A (0.52) ADH1BADH1CADH1AADH4ADH7
SCHEMBL6240484 0.74 ALDH1A1 (0.35) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1795365 0.74 CA2 (0.37) ADH1BADH1CADH1AADH4ADH7
SCHEMBL92880 0.72 CYP1A2 (0.37) ADH1BADH1CADH1AADH4ADH7
SCHEMBL16510242 0.72 ADH1B (0.34) ADH1BADH1CADH1AADH4ADH7
SCHEMBL21602919 0.72 CA2 (0.41) ADH1BADH1CADH1AADH4ADH7
SCHEMBL965016 0.72 ADH1B (0.34) ADH1BADH1CADH1AADH4ADH7

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-8158638-B2 Pyrazolopyrimidine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-04-17 US disclosed
EP-2065388-B1 PYRAZOLOPYRIMIDINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2011-09-07 EP disclosed
US-20100113410-A1 PYRAZOLOPYRIMIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-05-06 US disclosed
EP-2065388-A1 PYRAZOLOPYRIMIDINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2009-06-03 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-20100113410-A1 PYRAZOLOPYRIMIDINE DERIVATIVE HSP90AB1, HSP90B1, HSP90AA1 ADH1B 3956/4885ADH1C 2689/4885ADH1A 2568/4885

“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.