SCHEMBL2570407

SCHEMBL2570407

NCc1ccc(-c2cccc(OCCCCNC(=O)OCc3ccccc3)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
HTT P42858 1/20 0.50
MTNR1A P48039 3/20 0.49
MTNR1B P49286 3/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TGM2 P21980 1/20 0.48
MGLL Q99685 1/20 0.48

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
SCHEMBL2566852 0.97 L3MBTL1 (0.56) MAPTL3MBTL1HTTMMP2MMP9
SCHEMBL2572110 0.94 L3MBTL1 (0.60) MAPTL3MBTL1LMNASMN1; SMN2MGLL
SCHEMBL2571187 0.91 CFD (0.55) MAPTL3MBTL1HTTLMNASMN1; SMN2
SCHEMBL2571482 0.88 L3MBTL1 (0.58) MAPTL3MBTL1HTTMMP2MMP9
SCHEMBL2570580 0.86 L3MBTL1 (0.54) MAPTL3MBTL1HTTMMP2MMP9
SCHEMBL2571978 0.86 HTT (0.53) HTTMMP2MMP9LMNASMN1; SMN2
SCHEMBL2572901 0.85 SUCNR1 (0.49) MAPTL3MBTL1MTNR1AMTNR1B
SCHEMBL2571056 0.83 L3MBTL1 (0.57) MAPTL3MBTL1LMNASMN1; SMN2MGLL
SCHEMBL2572271 0.82 L3MBTL1 (0.54) MAPTL3MBTL1HTTLMNASMN1; SMN2
SCHEMBL2569250 0.81 MAPT (0.51) MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1813623-B1 PURINENUCLEOSIDE DERIVATIVE MODIFIED IN 8-POSITION AND MEDICINAL USE THEREOF KISSEI PHARMACEUTICAL (JP) 2011-11-09 EP disclosed
US-20100249054-A9 PURINE NUCLEOSIDE DERIVATIVE MODIFIED IN 8-POSITION AND MEDICAL USE THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-09-30 US disclosed
US-7795236-B2 Purine nucleoside derivative modified in 8-position and medical use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-09-14 US disclosed
US-20070179115-A1 Purinenucleoside derivative modified in 8-position and medical use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
EP-1813623-A1 PURINENUCLEOSIDE DERIVATIVE MODIFIED IN 8-POSITION AND MEDICINAL USE THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2007-08-01 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 (2 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-20100249054-A9 PURINE NUCLEOSIDE DERIVATIVE MODIFIED IN 8-POSITION AND MEDICAL USE THEREOF NUDT1, PNP, SLC28A2 MAPT 3754/4885L3MBTL1 483/4885HTT 2709/4885
US-20070179115-A1 Purinenucleoside derivative modified in 8-position and medical use thereof NUDT1, SLC28A2, PNP MAPT 3869/4885L3MBTL1 342/4885HTT 2629/4885

“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.