SCHEMBL9799482

SCHEMBL9799482

O=C(O)N1CCc2c1c1cccnc1n(-c1cccc(Cl)c1)c2=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
HPGD P15428 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
PDE4B Q07343 4/20 0.40
PDE4D Q08499 4/20 0.40
FEN1 P39748 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
PDE4A P27815 5/20 0.37
PDE4C Q08493 3/20 0.37
ALDH1A1 P00352 3/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
KDM4E B2RXH2 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPK1 P28482 1/20 0.36
TP53 P04637 1/20 0.35

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
SCHEMBL9799533 0.89 FEN1 (0.50) CYP2C19PDE4BPDE4DFEN1PDE4A
SCHEMBL9799505 0.86 MEN1 (0.47) MAPTMEN1CYP1A2HPGDCYP2C19
SCHEMBL9799483 0.82 PDE4A (0.46) MAPTMEN1CYP1A2HPGDCYP2C19
SCHEMBL9535601 0.78 MAPT (0.50) MAPTMEN1CYP1A2HPGDCYP2C19
SCHEMBL9726939 0.77 MAPT (0.43) MAPTMEN1CYP1A2HPGDCYP2C19
SCHEMBL9799632 0.76 FEN1 (0.50) MAPTHPGDCYP2C19PDE4BPDE4D
SCHEMBL9799534 0.75 MAPT (0.50) MAPTMEN1CYP1A2HPGDCYP2C19
SCHEMBL10379090 0.74 MAPT (0.46) MAPTMEN1CYP1A2HPGDCYP2C19
SCHEMBL9629146 0.74 MAPT (0.49) MAPTMEN1CYP1A2HPGDCYP2C19
SCHEMBL10377111 0.72 MAPT (0.47) MAPTMEN1CYP1A2HPGDCYP2C19

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
US-4996212-A Antiinflammatory and anti-hyperproliferative compounds SCHERING CORPORATION (US) 1991-02-26 US claimed
US-4859669-A Antiinflammatory and anti-hyperproliferative naphthyridin-4-ones SCHERING CORPORATION (US) 1989-08-22 US disclosed