SCHEMBL1748618

SCHEMBL1748618

CC(C)Oc1cc(O)cc(CN2CCC(Nc3nc(Cl)nc4c3CCC4)CC2)c1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 1/20 0.45
EHMT2 Q96KQ7 7/20 0.42
ALDH1A1 P00352 1/20 0.37
ACHE P22303 2/20 0.36
ROCK2 O75116 1/20 0.36
MEN1 O00255 1/20 0.35
CNR1 P21554 2/20 0.35
MCHR1 Q99705 1/20 0.35
NSD2 O96028 1/20 0.34
CXCR3 P49682 1/20 0.34

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
SCHEMBL1748584 0.94 SSTR5 (0.51) SSTR5EHMT2ALDH1A1ACHEROCK2
SCHEMBL1748421 0.82 EHMT2 (0.45) SSTR5EHMT2ACHEMEN1MCHR1
SCHEMBL1748412 0.81 SSTR5 (0.50) SSTR5ALDH1A1ACHEROCK2CNR1
SCHEMBL1748445 0.80 SSTR5 (0.46) SSTR5EHMT2MCHR1NSD2
SCHEMBL1748392 0.79 SSTR5 (0.47) SSTR5EHMT2
SCHEMBL1748840 0.78 SSTR5 (0.55) SSTR5EHMT2ALDH1A1ACHEMCHR1
SCHEMBL1748582 0.77 EHMT2 (0.49) SSTR5EHMT2ACHEMEN1MCHR1
SCHEMBL1748159 0.77 SSTR5 (0.50) SSTR5ACHECXCR3
SCHEMBL1748398 0.77 SSTR5 (0.54) SSTR5EHMT2ALDH1A1
SCHEMBL1748524 0.76 SSTR5 (0.52) SSTR5EHMT2

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
US-7968568-B2 [1-(4-chloro-3-ethoxy-benzyl)-piperidin-4-yl]-(2-chloro-pyrimidin-4-yl)-amine; somatostatin receptor subtype 5 (SSTR5) antagonists; diabetes mellitus HOFFMANN-LA ROCHE INC. (US) 2011-06-28 US disclosed
EP-2044054-B1 PYRIMIDINE AND QUINAZOLINE DERIVATIVES AS MODULATORS OF SOMATOSTATINE RECEPTOR ACTIVITY HOFFMANN LA ROCHE (CH) 2011-06-08 EP disclosed
US-20100069413-A1 Pyrimidine and Quinazoline Derivatives CHRIST ANDREAS D 2010-03-18 US disclosed
US-7674804-B2 Pyrimidine and quinazoline derivatives as SST5 modulators HOFFMANN-LA ROCHE INC. (US) 2010-03-09 US disclosed
US-20080045550-A1 Pyrimidine and quinazoline derivatives F. HOFFMANN-LA ROCHE AG (CH) 2008-02-21 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 (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-20100069413-A1 Pyrimidine and Quinazoline Derivatives SSTR5, SSTR3, NPY5R SSTR5 1/4885EHMT2 4858/4885ALDH1A1 2667/4885
US-20080045550-A1 Pyrimidine and quinazoline derivatives SSTR5, SSTR3, NPY5R SSTR5 1/4885EHMT2 4858/4885ALDH1A1 2667/4885

“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.