SCHEMBL5870552

SCHEMBL5870552

O=C1[N]C(=O)c2c1cccc2N1C(=O)CCC1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.39
TP53 P04637 1/20 0.39
RECQL P46063 1/20 0.38
KMT2A Q03164 8/20 0.37
MEN1 O00255 4/20 0.37
RAF1 P04049 2/20 0.37
MAP2K1 Q02750 2/20 0.37
MAPK3 P27361 1/20 0.37
MAP3K8 P41279 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.35
MAPK1 P28482 3/20 0.33
MAPT P10636 4/20 0.33
ALDH1A1 P00352 4/20 0.33
EGFR P00533 2/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
CCKBR P32239 1/20 0.33
GABRA3 P34903 1/20 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
SCHEMBL2552173 0.81 MGLL (0.53) ALDH1A1MGLLHTTPKMNPSR1
SCHEMBL2403872 0.81 POLB (0.51) KMT2AMEN1ALDH1A1NR1H2POLB
SCHEMBL11516791 0.74 TDP1 (0.40) HPGDTP53RECQLKMT2AMEN1
SCHEMBL321441 0.73 TP53 (0.37) HPGDTP53KMT2AMGLL
SCHEMBL11110156 0.72 KMT2A (0.61) HPGDTP53KMT2AMEN1RAF1
SCHEMBL7154016 0.71 MGLL (0.63) HPGDTP53KMT2AMEN1RAF1
SCHEMBL6341570 0.70 TLR9 (0.52) HPGDTP53RECQLKMT2AMEN1
SCHEMBL11514963 0.68 KMT2A (0.43) HPGDTP53KMT2AMEN1RAF1
SCHEMBL4850007 0.66 MAOA (0.56) HPGDTP53RECQLKMT2AMEN1
SCHEMBL2884290 0.66 CA1 (0.46) KMT2AMEN1L3MBTL1MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7033425-B2 Mixture of cyan ink containing phthalocyanine dye in aqueous solution, magenta ink containing azo-naphthol dye, yellow ink containing pyrazolone dye, black ink containing metallized dye EASTMAN KODAK COMPANY (US) 2006-04-25 US disclosed
US-20050229810-A1 Ink jet ink set EASTMAN KODAK COMPANY 2005-10-20 US disclosed
US-6403608-B1 ANTIINFLAMMATORY AND IMMUNE DISORDERS CELLTECH R&D, LTD. (GB) 2002-06-11 US disclosed