SCHEMBL1880245

SCHEMBL1880245

COc1ccc(CN2CCC(Nc3ccnc4ccccc34)CC2)cc1OC(C)C

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 14/20 0.54
MCHR1 Q99705 1/20 0.53
HRH1 P35367 1/20 0.52
HTR2B P41595 1/20 0.52
APP P05067 1/20 0.51
ACHE P22303 1/20 0.50
EZH2 Q15910 1/20 0.47
NSD2 O96028 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
SCHEMBL1881707 0.90 SSTR5 (0.67) SSTR5MCHR1HRH1HTR2BAPP
SCHEMBL1878181 0.90 SSTR5 (0.55) SSTR5MCHR1HRH1HTR2B
SCHEMBL1877815 0.89 SSTR5 (0.65) SSTR5MCHR1HRH1HTR2BAPP
SCHEMBL1877870 0.89 KDM4E (0.60) SSTR5MCHR1HRH1HTR2BACHE
SCHEMBL1879972 0.88 SSTR5 (0.66) SSTR5MCHR1HRH1HTR2BAPP
SCHEMBL1873230 0.88 SSTR5 (0.66) SSTR5MCHR1HRH1HTR2BAPP
SCHEMBL1876374 0.87 SSTR5 (0.67) SSTR5MCHR1HRH1HTR2BAPP
SCHEMBL1882159 0.87 SSTR5 (0.61) SSTR5MCHR1HRH1HTR2BAPP
SCHEMBL1878808 0.87 SSTR5 (0.53) SSTR5MCHR1HRH1HTR2BAPP
SCHEMBL1874053 0.86 SSTR5 (0.53) SSTR5MCHR1HRH1HTR2BAPP

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 4 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
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 1/4885MCHR1 207/4885HRH1 97/4885

“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.