SCHEMBL861595

SCHEMBL861595

NC1CCC(N2CCN(C(=O)O)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.41
KCNH2 Q12809 3/20 0.41
POLB P06746 2/20 0.40
HSD17B10 Q99714 1/20 0.40
KDM4E B2RXH2 7/20 0.38
ALDH1A1 P00352 5/20 0.38
L3MBTL3 Q96JM7 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL65329 0.89 HRH3 (0.47) HRH3KCNH2POLBHSD17B10KDM4E
SCHEMBL2553841 0.85 HRH3 (0.44) HRH3KCNH2POLBHSD17B10KDM4E
SCHEMBL2550326 0.83 L3MBTL3 (0.46) HRH3KCNH2KDM4EALDH1A1L3MBTL3
SCHEMBL31397626 0.82 CYP1A2 (0.43) HRH3KCNH2POLBHSD17B10KDM4E
SCHEMBL3590543 0.82 HRH3 (0.42) HRH3KCNH2POLBHSD17B10KDM4E
SCHEMBL65252 0.81 POLB (0.52) HRH3KCNH2POLBHSD17B10KDM4E
SCHEMBL3768409 0.81 POLB (0.56) HRH3KCNH2POLBHSD17B10KDM4E
SCHEMBL22570087 0.81 ALDH1A1 (0.48) HRH3KCNH2ALDH1A1
SCHEMBL30528546 0.81 ALDH1A1 (0.48) HRH3KCNH2ALDH1A1
SCHEMBL16372109 0.80 PHGDH (0.32) HRH3KCNH2KDM4EALDH1A1L3MBTL3

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 HRH3 33/4885KCNH2 2030/4885POLB 3428/4885
US-20110166343-A1 THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY PDE7A, PDE7B, PDE3B HRH3 33/4885KCNH2 2030/4885POLB 3428/4885
US-20090131413-A1 Thienopyrazole Derivative Having PDE7 Inhibitory Activity PDE7A, PDE7B, PDE3B HRH3 33/4885KCNH2 2030/4885POLB 3428/4885

“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.