SCHEMBL3635827

SCHEMBL3635827

CCOc1cc(CN2CCC(Nc3nc(-c4ccc(F)cc4)co3)CC2)cc(OCC)c1Cl

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 20/20 0.54
SSTR1 P30872 1/20 0.54
HRH1 P35367 4/20 0.49
HTR2B P41595 2/20 0.49
KCNH2 Q12809 2/20 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
SCHEMBL3635221 0.93 SSTR5 (0.61) SSTR5HRH1HTR2BKCNH2
SCHEMBL3635052 0.93 SSTR5 (0.55) SSTR5SSTR1HRH1HTR2B
SCHEMBL3637788 0.92 SSTR5 (0.55) SSTR5HRH1KCNH2
SCHEMBL3638232 0.92 SSTR5 (0.55) SSTR5HRH1HTR2BKCNH2
SCHEMBL3637751 0.91 SSTR5 (0.57) SSTR5SSTR1HRH1HTR2B
SCHEMBL3633858 0.90 SSTR5 (0.55) SSTR5HRH1HTR2B
SCHEMBL3639952 0.90 SSTR5 (0.59) SSTR5SSTR1HRH1HTR2BKCNH2
SCHEMBL3636310 0.89 SSTR5 (0.55) SSTR5HRH1KCNH2
SCHEMBL3637799 0.89 SSTR5 (0.60) SSTR5HRH1HTR2BKCNH2
SCHEMBL5009640 0.87 SSTR5 (0.50) SSTR5HRH1KCNH2

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
CN-101679368-A Aryl azoles, aryl diazole and benzimidizole derivatives HOFFMANN LA ROCHE 2010-03-24 CN claimed
EP-2155718-A2 ARYLOXAZOLE, ARYLOXADIAZOLE AND BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF SOMATOSTATINE RECEPTOR ACTIVITY F. Hoffmann-Roche AG (CH) 2010-02-24 EP claimed
WO-2008148710-A2 ARYLOXAZOLE, ARYLOXADIAZOLE AND BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF SOMATOSTATINS RECEPTOR ACTIVITY F. HOFFMANN-LA ROCHE AG (CH) 2008-12-11 WO claimed
US-20080306116-A1 ARYLOXAZOLE, ARYLOXADIAZOLE AND BENZIMIDAZOLE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2008-12-11 US claimed
CN-101679368-A Aryl azoles, aryl diazole and benzimidizole derivatives HOFFMANN LA ROCHE 2010-03-24 CN disclosed
US-20080306116-A1 ARYLOXAZOLE, ARYLOXADIAZOLE AND BENZIMIDAZOLE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2008-12-11 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-20080306116-A1 ARYLOXAZOLE, ARYLOXADIAZOLE AND BENZIMIDAZOLE DERIVATIVES SSTR5, NPY5R, SSTR3 SSTR5 1/4885SSTR1 6/4885HRH1 207/4885

“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.