SCHEMBL9726410

SCHEMBL9726410

CC(C)n1ncc(NCc2ccccc2)c(Cl)c1=O

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 6/20 0.70
BRD9 Q9H8M2 4/20 0.70
KAT2B Q92831 4/20 0.70
BPTF Q12830 2/20 0.56
PDE9A O76083 3/20 0.54
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
NPBWR1 P48145 1/20 0.50
MCHR1 Q99705 1/20 0.50
MAPK14 Q16539 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.48
RAB9A P51151 3/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.47
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL10599280 0.88 BRD4 (0.70) BRD4BRD9KAT2BBPTFPDE9A
SCHEMBL10601213 0.87 BRD4 (0.73) BRD4BRD9KAT2BBPTFPDE9A
SCHEMBL9726637 0.87 BPTF (0.54) BRD4BRD9KAT2BBPTFPDE9A
SCHEMBL9726428 0.86 BRD4 (0.56) BRD4BRD9KAT2BBPTFPDE9A
SCHEMBL10603023 0.85 BPTF (0.55) BRD4BRD9KAT2BBPTFPDE9A
SCHEMBL9726508 0.85 BRD4 (0.52) BRD4BRD9KAT2BBPTFPDE9A
SCHEMBL10601786 0.83 BPTF (0.53) BRD4BRD9KAT2BBPTFPDE9A
SCHEMBL10599814 0.83 BRD4 (0.54) BRD4BRD9KAT2BBPTFPDE9A
SCHEMBL9726528 0.82 BRD4 (0.52) BRD4BRD9KAT2BBPTFPDE9A
SCHEMBL9726598 0.80 BPTF (0.52) BRD4BRD9KAT2BBPTFPDE9A

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-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
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