SCHEMBL6647263

SCHEMBL6647263

CC(C)(C)OC(=O)ON1CCN(c2cccc(C(=C3CN(C(c4ccc(Cl)cc4)c4ccc(Cl)cc4)C3)S(C)(=O)=O)c2)CC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.36
ENPP2 Q13822 1/20 0.35
GPR119 Q8TDV5 1/20 0.34
NR1H2 P55055 5/20 0.34
NR1H3 Q13133 5/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.33
PANK3 Q9H999 1/20 0.33
CNR1 P21554 1/20 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
SCHEMBL6644469 0.92 HTR2C (0.38) HTR2CENPP2ALDH1A1LMNAPANK3
SCHEMBL7123729 0.89 ENPP2 (0.39) HTR2CENPP2ALDH1A1LMNAPANK3
SCHEMBL6011781 0.88 GPR119 (0.44) ENPP2GPR119NR1H2NR1H3CNR1
SCHEMBL6648472 0.87 HTR2C (0.37) HTR2CENPP2ALDH1A1LMNAPANK3
SCHEMBL5077591 0.83 ALDH1A1 (0.41) HTR2CENPP2ALDH1A1LMNACNR1
SCHEMBL6011689 0.83 KMT2A (0.44) ENPP2ALDH1A1LMNA
SCHEMBL5075675 0.83 ENPP2 (0.43) HTR2CENPP2ALDH1A1LMNAPANK3
SCHEMBL5082046 0.83 CYP3A4 (0.45) HTR2CENPP2ALDH1A1LMNAPANK3
SCHEMBL6011570 0.82 TP53 (0.42) ENPP2ALDH1A1LMNA
SCHEMBL6011375 0.82 SMN1; SMN2 (0.43) HTR2CENPP2ALDH1A1PANK3CNR1

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-1478645-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS Amgen Inc. (US) 2004-11-24 EP disclosed
WO-2003066630-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS AMGEN INC. (US) 2003-08-14 WO disclosed