SCHEMBL3359175

SCHEMBL3359175

O=c1[nH]c2cccc(C(F)(F)F)c2cc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 10/20 0.64
DDO Q99489 6/20 0.64
KIF11 P52732 1/20 0.46
AXL P30530 1/20 0.42
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 1/20 0.42
IDE P14735 1/20 0.42
MPI P34949 1/20 0.42
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
AR P10275 1/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL3363456 0.78 DAO (1.00) DAODDOKDM4EALDH1A1MAPT
SCHEMBL3431869 0.77 DAO (0.49) DAODDOAR
SCHEMBL15690473 0.75 DAO (0.65) DAODDOKDM4EALDH1A1MAPT
SCHEMBL16767849 0.75 DAO (1.00) DAODDOKDM4EALDH1A1MAPT
SCHEMBL3423807 0.75 DAO (1.00) DAODDOKDM4EALDH1A1MAPT
SCHEMBL3418623 0.74 DAO (0.64) DAODDOKIF11KDM4EALDH1A1
SCHEMBL1144458 0.74 KDM4E (0.53) DAOKIF11AXLKDM4EALDH1A1
SCHEMBL30310417 0.74 KDM4E (0.53) DAOKIF11AXLKDM4EALDH1A1
SCHEMBL3715319 0.73 EGFR (0.44) DAODDOKDM4EALDH1A1AR
SCHEMBL3787127 0.73 KIF11 (0.51) KIF11AXLKDM4EALDH1A1AR

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