SCHEMBL3359580

SCHEMBL3359580

Cc1ccc(Cl)c2[nH]c(=O)c(O)c(F)c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.49
CLCN2 P51788 1/20 0.49
DAO P14920 3/20 0.37
CAPN1 P07384 1/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSH P09668 1/20 0.36
GRIN2D O15399 5/20 0.35
GRIN3B O60391 5/20 0.35
GRIN1 Q05586 5/20 0.35
GRIN2A Q12879 5/20 0.35
GRIN2B Q13224 5/20 0.35
GRIN2C Q14957 5/20 0.35
GRIN3A Q8TCU5 5/20 0.35
MET P08581 2/20 0.34
KDM4E B2RXH2 1/20 0.34
DDO Q99489 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL3359777 0.87 MEN1 (0.43) ADRA2ACLCN2DAOGRIN2DGRIN3B
SCHEMBL3426119 0.86 DAO (0.41) ADRA2ACLCN2DAOGRIN2DGRIN3B
SCHEMBL3424330 0.83 ADRA2A (0.44) ADRA2ACLCN2DAOGRIN2DGRIN3B
SCHEMBL3425826 0.81 DAO (0.37) ADRA2ACLCN2DAOGRIN2DGRIN3B
SCHEMBL3422204 0.72 DAO (0.49) DAOGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7784347 0.71 DAO (0.46) ADRA2ACLCN2DAOGRIN2DGRIN3B
SCHEMBL1983234 0.68 MEN1 (0.43) ADRA2ACLCN2DAOMETKDM4E
SCHEMBL3360284 0.67 GRIN2D (0.60) DAOGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6736528 0.67 ADRA2A (0.41) ADRA2ACLCN2CAPN1CTSLCTSB
SCHEMBL3420842 0.67 DAO (0.38) 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 1 patent. 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 disclosed