SCHEMBL9498048

SCHEMBL9498048

O=c1c(Cl)cc2ccccc2n1O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
DAO P14920 2/20 0.50
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SLC22A12 Q96S37 1/20 0.39
HIF1A Q16665 1/20 0.39
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 2/20 0.38
PKM P14618 1/20 0.38
CCR2 P41597 2/20 0.37
MAPK1 P28482 1/20 0.37
AHR P35869 1/20 0.37
ERCC1 P07992 1/20 0.37
FEN1 P39748 1/20 0.37
ERCC4 Q92889 1/20 0.37
MCL1 Q07820 1/20 0.37
NOTUM Q6P988 1/20 0.37

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
SCHEMBL14127154 0.80 DAO (0.43) KDM4EDAOKMT2ASLC22A12HTT
SCHEMBL6382774 0.78 DAO (0.65) KDM4EDAOMEN1KMT2APOLB
SCHEMBL7163743 0.77 KDM4E (0.52) KDM4EDAOMEN1KMT2ALMNA
SCHEMBL10677691 0.77 KDM4E (0.52) KDM4EDAOMEN1KMT2ALMNA
SCHEMBL28165616 0.77 DAO (0.62) KDM4EDAOMEN1KMT2ALMNA
SCHEMBL9499552 0.74 DAO (0.51) KDM4EDAOKMT2AFEN1
SCHEMBL9849536 0.74 DAO (0.61) KDM4EDAOLMNACCR2AHR
SCHEMBL28325706 0.73 LMNA (0.48) KDM4EMEN1KMT2AHTTLMNA
SCHEMBL9496407 0.73 DAO (0.47) KDM4EDAOMEN1KMT2AHTT
SCHEMBL9849401 0.73 DAO (0.50) KDM4EDAOMEN1KMT2ACCR2

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
EP-0240859-B1 LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1993-04-28 EP disclosed