SCHEMBL3418623

SCHEMBL3418623

O=c1[nH]c2c(C(F)(F)F)cccc2cc1O

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DAO P14920 12/20 0.64
DDO Q99489 5/20 0.64
HRH4 Q9H3N8 2/20 0.47
KDM4E B2RXH2 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.41
KIF11 P52732 1/20 0.39

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
SCHEMBL31422983 0.79 HRH4 (0.46) DAODDOHRH4KDM4ESMN1; SMN2
SCHEMBL3362300 0.78 DAO (1.00) DAODDOHRH4
SCHEMBL3434396 0.76 DAO (0.47) DAODDOKDM4EALDH1A1KMT2A
SCHEMBL15690441 0.75 DAO (0.65) DAODDOHRH4
SCHEMBL16767858 0.75 DAO (1.00) DAODDOHRH4
SCHEMBL16767856 0.75 DAO (1.00) DAODDOKDM4EALDH1A1LMNA
SCHEMBL1145047 0.74 HRH4 (0.60) DAOHRH4KDM4ESMN1; SMN2MEN1
SCHEMBL3359175 0.74 DAO (0.64) DAODDOKDM4ESMN1; SMN2MEN1
SCHEMBL3419432 0.74 DAO (0.51) DAODDOKDM4ESMN1; SMN2MEN1
SCHEMBL3432869 0.73 DAO (0.58) 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 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