SCHEMBL8552627

SCHEMBL8552627

Cc1cc(CCCC2CCCCN2C(=O)OCC(C)C)c2nc(COc3ccc(Cl)cc3)[nH]c2c1C

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
DGAT2 Q96PD7 1/20 0.34
NPY1R P25929 6/20 0.34
TSHR P16473 2/20 0.34
FFAR1 O14842 2/20 0.33
CHEK2 O96017 2/20 0.33
LTA4H P09960 3/20 0.33
HTR2A P28223 1/20 0.33
SPHK1 Q9NYA1 2/20 0.32

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
SCHEMBL8556902 0.87 DGAT2 (0.37) POLBDGAT2FFAR1CHEK2LTA4H
SCHEMBL8555457 0.84 DGAT2 (0.37) POLBDGAT2TSHRFFAR1CHEK2
SCHEMBL8555023 0.78 KMT2A (0.35) HTR2A
SCHEMBL8551701 0.76 DGAT2 (0.39) POLBDGAT2NPY1RCHEK2LTA4H
SCHEMBL8620953 0.74 DGAT2 (0.41) DGAT2NPY1RCHEK2HTR2A
SCHEMBL8551796 0.73 DGAT2 (0.42) DGAT2NPY1RCHEK2
SCHEMBL8551998 0.73 NPY1R (0.49) POLBNPY1R
SCHEMBL8555474 0.67 DGAT2 (0.36) DGAT2NPY1R
SCHEMBL8554479 0.66 NPY1R (0.45) DGAT2NPY1RTSHR
SCHEMBL8555848 0.66 DGAT2 (0.39) DGAT2CHEK2

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