SCHEMBL1880914

SCHEMBL1880914

CCOc1cc(CN2CCC(Nc3ccnc4ccccc34)CC2)cc(OCC)c1F

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 17/20 0.64
HRH1 P35367 3/20 0.53
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
KMT2A Q03164 1/20 0.52
KCNH2 Q12809 1/20 0.51
HTR2B P41595 2/20 0.49
MCHR1 Q99705 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
SCHEMBL4129632 0.91 SSTR5 (0.63) SSTR5HRH1KDM4EMEN1ALDH1A1
SCHEMBL1876792 0.91 SSTR5 (0.65) SSTR5HRH1KDM4EMEN1ALDH1A1
SCHEMBL1876062 0.90 SSTR5 (0.64) SSTR5HRH1KDM4EMEN1ALDH1A1
SCHEMBL1880457 0.90 KDM4E (0.54) SSTR5HRH1KDM4EMEN1ALDH1A1
SCHEMBL1881042 0.90 SSTR5 (0.52) SSTR5HRH1KDM4EMEN1ALDH1A1
SCHEMBL1875550 0.89 SSTR5 (0.60) SSTR5HRH1KDM4EMEN1ALDH1A1
SCHEMBL1876982 0.89 SSTR5 (0.57) SSTR5HRH1KCNH2
SCHEMBL1877469 0.89 KDM4E (0.68) SSTR5HRH1KDM4EMEN1ALDH1A1
SCHEMBL1878211 0.88 SSTR5 (0.53) SSTR5HRH1KDM4EMEN1ALDH1A1
SCHEMBL1879016 0.88 SSTR5 (0.65) SSTR5HRH1KDM4EMEN1ALDH1A1

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 1/4885HRH1 97/4885KDM4E 3759/4885

“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.