SCHEMBL7029862

SCHEMBL7029862

O=c1[nH]c(=O)c2c(CBr)cccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
CA12 O43570 1/20 0.44
PARP1 P09874 1/20 0.44
CA9 Q16790 1/20 0.44
GRIN2D O15399 4/20 0.36
GRIN3B O60391 4/20 0.36
GRIN1 Q05586 4/20 0.36
GRIN2A Q12879 4/20 0.36
GRIN2B Q13224 4/20 0.36
GRIN2C Q14957 4/20 0.36
GRIN3A Q8TCU5 4/20 0.36
DAO P14920 1/20 0.35
DDO Q99489 1/20 0.35
CHEK1 O14757 2/20 0.35
ALDH1A1 P00352 1/20 0.35
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
ELANE P08246 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
SCHEMBL7030747 0.84 DAO (0.46) KDM4ECA12PARP1CA9GRIN2D
SCHEMBL7021933 0.82 KDM4E (0.44) KDM4ECA12PARP1CA9GRIN2D
SCHEMBL31441271 0.81 CDK1 (0.42) KDM4ECA12PARP1CA9GRIN2D
SCHEMBL7034886 0.79 KDM4E (0.42) KDM4ECA12PARP1CA9GRIN2D
SCHEMBL7025030 0.79 HCAR2 (0.48) KDM4ECA12PARP1CA9DAO
SCHEMBL7028926 0.78 KDM4E (0.41) KDM4ECA12PARP1CA9GRIN2D
SCHEMBL12652515 0.78 GRIN2D (0.58) KDM4ECA12PARP1CA9GRIN2D
SCHEMBL1801055 0.78 GAA (0.42) KDM4ECA12PARP1CA9GRIN2D
SCHEMBL12617494 0.76 PARP1 (0.39) KDM4ECA12PARP1CA9GRIN2D
SCHEMBL30013511 0.76 FEN1 (0.50) KDM4ECA12PARP1CA9GRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0878468-B1 Process for producing 1-substituted tetrahydroquinazolines SUMITOMO CHEMICAL CO (JP) 2003-03-19 EP disclosed
EP-0775697-B1 Process for producing 1-substituted tetrahydroquinazolindionen SUMITOMO CHEMICAL CO (JP) 2003-02-12 EP disclosed
US-5994542-A Process for producing 1-substituted tetrahydroquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-11-30 US disclosed
EP-0878468-A1 Process for producing 1-substituted tetrahydroquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-11-18 EP disclosed
US-5756738-A Process for producing 1-substituted tetrahydroquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-05-26 US disclosed
EP-0775697-A1 Process for producing 1-substituted tetrahydroquinazolindionen SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-05-28 EP disclosed