SCHEMBL6651377

SCHEMBL6651377

OCCC[N]c1ccncc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.40
NOS3 P29474 2/20 0.35
NOS1 P29475 2/20 0.35
NOS2 P35228 2/20 0.35
PRKD3 O94806 1/20 0.31
MAP4K4 O95819 1/20 0.31
FRK P42685 1/20 0.31
MAPK9 P45984 1/20 0.31
CSNK1A1 P48729 1/20 0.31
CSNK1D P48730 1/20 0.31
GSK3B P49841 1/20 0.31
PRKD2 Q9BZL6 1/20 0.31
MAP4K5 Q9Y4K4 1/20 0.31
NAAA Q02083 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
LOXL2 Q9Y4K0 1/20 0.30

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
SCHEMBL10502034 0.77 ALDH1A1 (0.38) NOS3NOS1LMNA
SCHEMBL5509601 0.73 NOS3 (0.41) PLGNOS3NOS1NOS2NAAA
SCHEMBL7973571 0.71 LOXL2 (0.37) NAAAMAPTLOXL2
SCHEMBL10503151 0.70 MIF (0.35) LMNA
SCHEMBL10914555 0.68 NAPRT (0.42) NAAALMNA
SCHEMBL7794049 0.68 HTR3A (0.39) NOS3NOS1NOS2LMNAMAPT
SCHEMBL5490413 0.68 ADRA2A (0.32) NOS3NOS1
SCHEMBL1871119 0.67
SCHEMBL6649246 0.66 CYP3A4 (0.54) GSK3BLMNA
SCHEMBL279761 0.65 HRH1 (0.56) NAAALOXL2

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