SCHEMBL9726415

SCHEMBL9726415

CCCn1ncc(NCc2ccc(OC)c(OC)c2)c(Cl)c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.49
BRD9 Q9H8M2 3/20 0.49
KAT2B Q92831 2/20 0.48
BPTF Q12830 2/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 2/20 0.46
POLB P06746 2/20 0.46
LMNA P02545 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
STAT1 P42224 1/20 0.42
FLT1 P17948 1/20 0.42
KDR P35968 1/20 0.42
PDE5A O76074 1/20 0.41

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
SCHEMBL9726448 0.91 BRD4 (0.47) BRD4BRD9KAT2BBPTFKMT2A
SCHEMBL9827204 0.89 BRD4 (0.47) BRD4BRD9KAT2BBPTFHTT
Hydrochloric Acid SCHEMBL10423228 0.88 BRD4 (0.46) BRD4BRD9KAT2BBPTFHTT
SCHEMBL9828337 0.86 BRD4 (0.46) BRD4BRD9KAT2BBPTFKMT2A
SCHEMBL9726673 0.85 BRD4 (0.46) BRD4BRD9KAT2BBPTFHTT
SCHEMBL9829518 0.85 HTT (0.43) BRD4BRD9KAT2BBPTFHTT
SCHEMBL9726619 0.83 BRD4 (0.49) BRD4BRD9KAT2BBPTFKMT2A
SCHEMBL9726665 0.82 BRD4 (0.48) BRD4BRD9KAT2BBPTFKMT2A
SCHEMBL9726598 0.81 BPTF (0.52) BRD4BRD9KAT2BBPTFKMT2A
SCHEMBL9829158 0.79 EPHX2 (0.38) BRD4BRD9KAT2BBPTFHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61267560-A None JP disclosed
US-5098900-A Reducing contractions in smooth muscles NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-03-24 US disclosed
EP-0186817-B1 3(2H)PYRIDAZINONE, PROCESS FOR ITS PREPARATION AND ANTI-ALLERGIC AGENT CONTAINING IT NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1989-08-02 EP disclosed
JP-S61267560-A PYRIDAZINONE DERIVATIVE NISSAN CHEM IND LTD 1986-11-27 JP disclosed
EP-0186817-A1 3(2H)pyridazinone, process for its preparation and anti-allergic agent containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1986-07-09 EP disclosed