SCHEMBL8067979

SCHEMBL8067979

Cc1cc2[nH]c(=O)c3nn[nH]c3c(=O)c2cc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.39
DDO Q99489 2/20 0.39
SRC P12931 2/20 0.38
GRIN2D O15399 3/20 0.36
GRIN3B O60391 3/20 0.36
GRIN1 Q05586 3/20 0.36
GRIN2A Q12879 3/20 0.36
GRIN2B Q13224 3/20 0.36
GRIN2C Q14957 3/20 0.36
GRIN3A Q8TCU5 3/20 0.36
CHEK1 O14757 6/20 0.36
PRKACA P17612 1/20 0.33
PRKACG P22612 1/20 0.33
PRKACB P22694 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL7824882 0.88 GRIN2D (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7824147 0.82 KDM4E (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7831092 0.79 MEN1 (0.48) SRCCHEK1GAA
SCHEMBL7816523 0.79 CHEK1 (0.51) DAOCHEK1KDM4EALDH1A1GLA
SCHEMBL7827947 0.79 PTGES (0.43) DAODDOGRIN2DGRIN3BGRIN1
SCHEMBL7831634 0.79 GAA (0.42) SRCGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1115295 0.78 ALDH1A1 (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7826265 0.75 CSNK2A1 (0.41) KDM4EGAA
SCHEMBL8067091 0.75 ULK1 (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8066743 0.74 ABCB1 (0.46) DAOGRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6093714-A AN ANTIALLERGENS FOR TREATMENT AND PREVENTION OF BRONCHIAL ASTHMA, ECZEMA, HIVES, ALLERGIC GASTROINTESTINAL TROUBLES, ALLERGIC RHINITIS, ALLERGIC CONJUNCTIVITIS MEIJI SEIKA KAISHA, LTD. (JP) 2000-07-25 US disclosed
EP-0834512-A1 TRICYCLIC BENZAZEPINE COMPOUNDS MEIJI SEIKA KAISHA LTD. (JP) 1998-04-08 EP disclosed