SCHEMBL27368475

SCHEMBL27368475

COC(=O)c1c([C]=O)nc2cc(Cl)ccc2c1O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.45
PLA2G2A P14555 4/20 0.44
KMT2A Q03164 2/20 0.41
NR4A2 P43354 1/20 0.39
POLB P06746 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CHEK1 O14757 1/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
ABL1 P00519 1/20 0.38
MAP2K4 P45985 1/20 0.38
MEN1 O00255 1/20 0.37
PHLPP2 Q6ZVD8 1/20 0.37

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
SCHEMBL5754093 0.83 EGFR (0.53) EGFRPLA2G2AKMT2ANR4A2POLB
SCHEMBL6231653 0.81 EGFR (0.48) EGFRPLA2G2AKMT2ANR4A2POLB
SCHEMBL5755105 0.81 EGFR (0.48) EGFRPLA2G2AKMT2ANR4A2POLB
SCHEMBL9055766 0.80 NQO2 (0.39) PLA2G2AKMT2APOLB
SCHEMBL27559336 0.78 EGFR (0.48) EGFRPLA2G2AKMT2APOLBHPGD
SCHEMBL8574404 0.74 EGFR (0.55) EGFRPLA2G2AKMT2ANR4A2RXFP1
SCHEMBL11778609 0.73 PLA2G2A (0.56) EGFRPLA2G2AKMT2APOLBHPGD
SCHEMBL8571325 0.72 PLA2G2A (0.55) EGFRPLA2G2AKMT2ANR4A2POLB
SCHEMBL8572727 0.72 EGFR (0.53) EGFRPLA2G2AKMT2ANR4A2RXFP1
SCHEMBL2904899 0.71 EGFR (0.46) EGFRPLA2G2AKMT2ANR4A2RXFP1

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
CN-1053189-C pyridazino quinoline compounds ZENECA LTD (GB) 2000-06-07 CN disclosed
CN-1171787-A Pyridazinoquinoline compounds ZENECA LTD (GB) 1998-01-28 CN disclosed
CN-1138332-A Pyridazinoquinoline compounds ZENECA LTD (GB) 1996-12-18 CN disclosed