SCHEMBL9828337

SCHEMBL9828337

COc1ccc(CNc2cnn(CC(=O)O)c(=O)c2Cl)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 4/20 0.46
BRD9 Q9H8M2 3/20 0.46
KAT2B Q92831 2/20 0.46
KMT2A Q03164 4/20 0.45
POLB P06746 2/20 0.45
PDE5A O76074 1/20 0.44
BPTF Q12830 1/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
FLT1 P17948 1/20 0.43
KDR P35968 1/20 0.43
MEN1 O00255 2/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL9726415 0.86 BRD4 (0.49) BRD4BRD9KAT2BKMT2APOLB
SCHEMBL9827204 0.83 BRD4 (0.47) BRD4BRD9KAT2BKMT2APOLB
Hydrochloric Acid SCHEMBL10423228 0.82 BRD4 (0.46) BRD4BRD9KAT2BKMT2APOLB
SCHEMBL9726665 0.81 BRD4 (0.48) BRD4BRD9KAT2BKMT2APOLB
SCHEMBL9726598 0.81 BPTF (0.52) BRD4BRD9KAT2BKMT2APOLB
SCHEMBL9726673 0.81 BRD4 (0.46) BRD4BRD9KAT2BKMT2APOLB
SCHEMBL9726619 0.80 BRD4 (0.49) BRD4BRD9KAT2BKMT2APOLB
SCHEMBL9726448 0.79 BRD4 (0.47) BRD4BRD9KAT2BKMT2APOLB
SCHEMBL9829518 0.79 HTT (0.43) BRD4BRD9KAT2BPDE5ABPTF
SCHEMBL9726487 0.76 BRD4 (0.50) BRD4BRD9KAT2BKMT2APOLB

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
EP-0201765-B1 3(2H)PYRIDAZINONE, PROCESS FOR ITS PREPARATION AND ANTI-ALLERGIC AGENT CONTAINING IT NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1991-09-18 EP disclosed
US-4892947-A 3(2H)Pyridazinone, process for its preparation and anti-allergic agent containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1990-01-09 US disclosed
EP-0201765-A2 3(2H)Pyridazinone, process for its preparation and anti-allergic agent containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1986-11-20 EP disclosed