SCHEMBL8552606

SCHEMBL8552606

CCCCOC(=O)N1CCCC(CCCCCc2ccc3[nH]c(COc4ccc(Cl)cc4)nc3c2C)C1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 1/20 0.43
NPY1R P25929 7/20 0.35
LMNA P02545 1/20 0.35
HRH2 P25021 1/20 0.34
HRH1 P35367 1/20 0.34
HRH4 Q9H3N8 1/20 0.34
HRH3 Q9Y5N1 3/20 0.33
CHEK2 O96017 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
ENPP2 Q13822 1/20 0.33
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33

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
SCHEMBL8550682 0.90 DGAT2 (0.44) DGAT2NPY1RLMNAHRH2HRH1
SCHEMBL8556963 0.86 DGAT2 (0.41) DGAT2NPY1RLMNA
SCHEMBL8555907 0.86 CHEK2 (0.43) DGAT2CHEK2
SCHEMBL8555463 0.85 GPR119 (0.40) DGAT2NPY1RCHEK2
SCHEMBL8554479 0.84 NPY1R (0.45) DGAT2NPY1RLMNAHRH2HRH1
SCHEMBL8551336 0.82 GPR119 (0.47) DGAT2NPY1RCHEK2
SCHEMBL7686453 0.81 DGAT2 (0.44) DGAT2NPY1RCHEK2
SCHEMBL8553139 0.80 DGAT2 (0.39) DGAT2NPY1RHRH4HRH3
SCHEMBL8555848 0.80 DGAT2 (0.39) DGAT2CHEK2
SCHEMBL8557980 0.79 NPY1R (0.42) DGAT2NPY1RHRH2HRH1ENPP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871442-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-10-21 EP disclosed
WO-1997025041-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-07-17 WO disclosed