SCHEMBL1879276

SCHEMBL1879276

C=CCOc1cc(CN2CCC(Nc3cnc4ccccc4c3)CC2)ccc1OC

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 17/20 0.56
HRH1 P35367 2/20 0.56
HTR2B P41595 1/20 0.56
APP P05067 1/20 0.51
ABCB1 P08183 1/20 0.49
ACHE P22303 1/20 0.48
KCNH2 Q12809 1/20 0.47

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
SCHEMBL1878273 0.92 SSTR5 (0.56) SSTR5HRH1HTR2BKCNH2
SCHEMBL1875485 0.91 SSTR5 (0.68) SSTR5HRH1HTR2BKCNH2
SCHEMBL1879762 0.89 SSTR5 (0.69) SSTR5HRH1HTR2BAPPABCB1
SCHEMBL1878708 0.89 SSTR5 (0.69) SSTR5HRH1HTR2BAPPABCB1
SCHEMBL1876998 0.89 SSTR5 (0.63) SSTR5HRH1HTR2BABCB1
SCHEMBL1881938 0.89 SSTR5 (0.69) SSTR5HRH1HTR2BAPPABCB1
SCHEMBL1880776 0.88 SSTR5 (0.55) SSTR5HRH1HTR2BAPPABCB1
SCHEMBL1877134 0.88 SSTR5 (0.56) SSTR5HRH1HTR2BAPPABCB1
SCHEMBL1878370 0.87 SSTR5 (0.68) SSTR5HRH1HTR2BAPPABCB1
SCHEMBL1878170 0.86 SSTR5 (0.51) SSTR5HRH1HTR2BAPPACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7939661-B2 Antidiabetic agents; somatostatin receptor subtype 5 modulators; noninsulin dependent diabetes mellitus; side effect reduction; synthesis HOFFMAN-LA ROCHE INC. (US) 2011-05-10 US claimed
US-20080064697-A1 PYRIDINE, QUINOLINE AND PYRIMIDINE DERIVATIVES HOFFMAN-LA ROCHE INC. 2008-03-13 US claimed
US-7939661-B2 Antidiabetic agents; somatostatin receptor subtype 5 modulators; noninsulin dependent diabetes mellitus; side effect reduction; synthesis HOFFMAN-LA ROCHE INC. (US) 2011-05-10 US disclosed
EP-2066658-A1 PYRIDINE- AND QUINOLINE-PYRIMIDINE-DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2009-06-10 EP disclosed
WO-2008031735-A1 PYRIDINE- AND QUINOLINE-PYRIMIDINE-DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-03-20 WO disclosed
US-20080064697-A1 PYRIDINE, QUINOLINE AND PYRIMIDINE DERIVATIVES HOFFMAN-LA ROCHE INC. 2008-03-13 US 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-20080064697-A1 PYRIDINE, QUINOLINE AND PYRIMIDINE DERIVATIVES SSTR5, SSTR3, NPY5R SSTR5 1/4885HRH1 97/4885HTR2B 103/4885

“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.