SCHEMBL3363264

SCHEMBL3363264

O=c1[nH]c2c(Cl)c(F)ccc2cc1O

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DAO P14920 16/20 0.61
DDO Q99489 7/20 0.61
TNF P01375 1/20 0.43
RIPK1 Q13546 1/20 0.43
ERCC1 P07992 1/20 0.41
ERCC4 Q92889 1/20 0.41
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2B Q13224 1/20 0.40
GRIN2C Q14957 1/20 0.40
GRIN3A Q8TCU5 1/20 0.40

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
SCHEMBL3364081 0.83 DAO (0.65) DAODDOGRIN2DGRIN3BGRIN1
SCHEMBL22198962 0.80 TNF (0.43) DAODDOTNFRIPK1GRIN2D
SCHEMBL3435254 0.80 DAO (0.61) DAODDO
SCHEMBL3363037 0.80 DAO (0.61) DAODDO
SCHEMBL3361624 0.78 DAO (0.58) DAODDO
SCHEMBL3432869 0.78 DAO (0.58) DAODDO
SCHEMBL22185211 0.78 TNF (0.41) DAODDOTNFRIPK1GRIN2D
SCHEMBL22184937 0.76 EIF4A3 (0.40) DAODDOTNFRIPK1GRIN2D
SCHEMBL3424009 0.76 DAO (0.57) DAODDO
SCHEMBL3362300 0.76 DAO (1.00) DAODDO

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
WO-2010058314-A1 HYDROXYQUINOLIN-2(1H)-ONES AND DERIVATIVES THEREOF PFIZER INC. (US) 2010-05-27 WO claimed
WO-2010058314-A1 HYDROXYQUINOLIN-2(1H)-ONES AND DERIVATIVES THEREOF PFIZER INC. (US) 2010-05-27 WO disclosed