SCHEMBL1748350

SCHEMBL1748350

CCOc1cc(CN2CCC(Nc3ncnc4[nH]cnc34)CC2)cc(OCC)c1Cl

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 16/20 0.49
SSTR1 P30872 2/20 0.49
NSD2 O96028 1/20 0.45
HRH1 P35367 2/20 0.43
HTR2B P41595 1/20 0.43
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.41
KCNH2 Q12809 1/20 0.41
LMNA P02545 1/20 0.39
RAB9A P51151 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NOD2 Q9HC29 1/20 0.39

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
SCHEMBL1748468 0.90 SSTR5 (0.55) SSTR5SSTR1NSD2HRH1HTR2B
SCHEMBL1748424 0.87 SSTR5 (0.50) SSTR5SSTR1NSD2HRH1HTR2B
SCHEMBL1748406 0.87 SSTR5 (0.54) SSTR5NSD2HRH1HTR2BMAPT
SCHEMBL1748443 0.87 SSTR5 (0.54) SSTR5NSD2HRH1HTR2BKCNH2
SCHEMBL1748447 0.86 SSTR5 (0.55) SSTR5SSTR1NSD2HRH1HTR2B
SCHEMBL1748510 0.84 SSTR5 (0.45) SSTR5NSD2HRH1HTR2BKCNH2
SCHEMBL1748625 0.81 SSTR5 (0.39) SSTR5SSTR1NSD2HRH1HTR2B
SCHEMBL1748399 0.80 SSTR5 (0.50) SSTR5NSD2MEN1MAPTLMNA
SCHEMBL1748446 0.79 SSTR5 (0.56) SSTR5NSD2HRH1HTR2BKCNH2
SCHEMBL1748624 0.78 SSTR5 (0.51) SSTR5NSD2HRH1HTR2BKCNH2

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-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
CN-101479257-A Pyrimidine and quinazoline derivatives HOFFMANN LA ROCHE (CH) 2009-07-08 CN 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 1/4885SSTR1 4/4885NSD2 3810/4885
US-20080045550-A1 Pyrimidine and quinazoline derivatives SSTR5, SSTR3, NPY5R SSTR5 1/4885SSTR1 4/4885NSD2 3810/4885

“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.