SCHEMBL853826

SCHEMBL853826

CN(C)C(=O)N1CCC(NC(=O)O)CC1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MAPT P10636 2/20 0.50
GAA P10253 1/20 0.46
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 1/20 0.45
NPSR1 Q6W5P4 2/20 0.44
PDE7A Q13946 1/20 0.44
EPHX2 P34913 5/20 0.42
EPHX1 P07099 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
SCHEMBL25306203 0.89 PDE7A (0.46) MEN1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL13866396 0.81 MEN1 (0.54) MEN1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL3075635 0.79 EPHX2 (0.47) MEN1KMT2ANPSR1EPHX2EPHX1
SCHEMBL6539120 0.79 EPHX2 (0.65) EPHX2EPHX1
SCHEMBL23573294 0.78 EPHX2 (0.51) MEN1KMT2AALDH1A1NPSR1EPHX2
SCHEMBL880503 0.77 CTSK (0.52) MEN1KMT2ASMN1; SMN2MAPTEPHX1
SCHEMBL23573275 0.76 EPHX2 (0.49) MEN1KMT2AALDH1A1NPSR1EPHX2
SCHEMBL23573274 0.76 EPHX2 (0.49) MEN1KMT2AALDH1A1NPSR1EPHX2
SCHEMBL12404037 0.76 MEN1 (0.50) MEN1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL23573559 0.76 EPHX2 (0.49) MEN1KMT2AALDH1A1NPSR1EPHX2

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
US-8901315-B2 Thienopyrazole derivative having PDE7 inhibitory activity DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-12-02 US disclosed
US-20140073799-A1 THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-03-13 US disclosed
EP-1775298-B1 THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY DAIICHI SANKYO CO LTD (JP) 2013-03-20 EP disclosed
EP-2433943-A1 Thienopyrazole derivatives having PDE7 inhibitory activity Daiichi Sankyo Company, Limited (JP) 2012-03-28 EP disclosed
US-20110166343-A1 THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-07-07 US disclosed
US-7932250-B2 Thienopyrazole derivative having PDE7 inhibitory activity DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-04-26 US disclosed
US-20090131413-A1 Thienopyrazole Derivative Having PDE7 Inhibitory Activity ASUBIO PHARMA CO., LTD. (JP) 2009-05-21 US disclosed
EP-1775298-A1 THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY Daiichi Asubio Pharma Co., Ltd. (JP) 2007-04-18 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 (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-20140073799-A1 THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY PDE7A, PDE7B, PDE3B MEN1 3519/4885KMT2A 3266/4885SMN1; SMN2 4191/4885
US-20110166343-A1 THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY PDE7A, PDE7B, PDE3B MEN1 3519/4885KMT2A 3266/4885SMN1; SMN2 4191/4885
US-20090131413-A1 Thienopyrazole Derivative Having PDE7 Inhibitory Activity PDE7A, PDE7B, PDE3B MEN1 3519/4885KMT2A 3266/4885SMN1; SMN2 4191/4885

“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.