SCHEMBL2552938

SCHEMBL2552938

[CH2]CCN1CC(C)OC(C)C1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.55
EBP Q15125 1/20 0.55
KDM4E B2RXH2 7/20 0.41
LMNA P02545 2/20 0.41
PDK1 Q15118 1/20 0.39
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GAA P10253 1/20 0.37
TDP1 Q9NUW8 3/20 0.36
ALDH1A1 P00352 2/20 0.36

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
SCHEMBL1784863 0.80 SIGMAR1 (0.48) SIGMAR1EBPKDM4ELMNAPDK1
SCHEMBL9449486 0.80 SIGMAR1 (0.48) SIGMAR1EBPKDM4ELMNAPDK1
SCHEMBL22858956 0.78 SIGMAR1 (0.69) SIGMAR1EBPKDM4ELMNAPDK1
SCHEMBL10129761 0.78 SIGMAR1 (0.69) SIGMAR1EBPKDM4ELMNAPDK1
SCHEMBL10129057 0.78 SIGMAR1 (0.69) SIGMAR1EBPKDM4ELMNAPDK1
SCHEMBL9922437 0.78 SIGMAR1 (0.69) SIGMAR1EBPKDM4ELMNAPDK1
SCHEMBL2008948 0.77 GBA1 (0.38) SIGMAR1EBP
SCHEMBL23254095 0.76 SIGMAR1 (0.55) SIGMAR1EBPKDM4ELMNAPDK1
SCHEMBL6044380 0.76 SIGMAR1 (0.55) SIGMAR1EBPKDM4ELMNAPDK1
SCHEMBL1564250 0.76 SIGMAR1 (0.55) SIGMAR1EBPKDM4ELMNAPDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011123937-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2011-10-13 WO claimed
US-10000449-B2 Bisarylsulfonamides useful in the treatment of inflammation and cancer KANCERA AB (SE) 2018-06-19 US disclosed
EP-2794009-B1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2017-08-30 EP disclosed
US-9718809-B2 Bisarylsulfonamides useful in the treatment of inflammation and cancer KANCERA AB (SE) 2017-08-01 US disclosed
US-20160221938-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2016-08-04 US disclosed
US-20150025068-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2015-01-22 US disclosed
EP-2794009-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER Kancera AB (SE) 2014-10-29 EP disclosed
WO-2013093095-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER KANCERA AB (SE) 2013-06-27 WO disclosed
WO-2011123937-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2011-10-13 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 (3 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-20150025068-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER NFKBIA, IL6, LITAF SIGMAR1 2347/4885EBP 509/4885KDM4E 2715/4885
US-20160221938-A1 BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER NFKBIA, IL6, LITAF SIGMAR1 2217/4885EBP 483/4885KDM4E 2807/4885
US-10000449-B2 Bisarylsulfonamides useful in the treatment of inflammation and cancer NFKBIA, IL6, LITAF SIGMAR1 2217/4885EBP 483/4885KDM4E 2807/4885

“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.