SCHEMBL3655868

SCHEMBL3655868

c1ccc(COc2cccc(Nc3ccc(Oc4cccc(N5CCOCC5)c4)cn3)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.51
MET P08581 2/20 0.47
ALKBH1 Q13686 1/20 0.45
MAPK14 Q16539 1/20 0.45
F10 P00742 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
PRKDC P78527 2/20 0.43
ATM Q13315 1/20 0.43
ERBB2 P04626 1/20 0.43
PTK6 Q13882 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
TGFBR1 P36897 1/20 0.42
CYP3A4 P08684 1/20 0.42
LRRK2 Q5S007 1/20 0.42
SLCO1B1 Q9Y6L6 1/20 0.42

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
SCHEMBL8064837 0.85 MET (0.51) DGAT1METKMT2AGABRG2GABRB3
SCHEMBL3651256 0.85 MET (0.51) DGAT1METMEN1KMT2ATGFBR1
SCHEMBL3655694 0.82 MET (0.63) METGABRG2GABRB3GABRA5TGFBR1
SCHEMBL3655673 0.81 MET (0.54) METGABRG2GABRB3GABRA5TGFBR1
SCHEMBL1263059 0.80 AGXT (0.61) ALKBH1MAPK14MEN1KMT2APRKDC
SCHEMBL3653527 0.80 MAOB (0.47) MEN1KMT2APTK6ALDH1A1
SCHEMBL3653531 0.77 APP (0.53) MEN1KMT2APTK6
SCHEMBL8068266 0.77 MET (0.49) METTGFBR1MAPK10
SCHEMBL8067028 0.74 PRKAA2 (0.46) MEN1KMT2AERBB2ALDH1A1
SCHEMBL27818696 0.74 CHEK1 (0.48) DGAT1MEN1KMT2AALDH1A1

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-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 US disclosed
US-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 US disclosed
US-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 US disclosed
EP-2205317-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES Senexis Limited (GB) 2010-07-14 EP disclosed
WO-2009044160-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2009-04-09 WO disclosed
WO-2009044160-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2009-04-09 WO 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-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES HCRTR1, HCRTR2, RTN3 DGAT1 3281/4885MET 463/4885ALKBH1 3200/4885

“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.