SCHEMBL8565737

SCHEMBL8565737

Fc1ccc(F)c(OCc2ccccc2)c1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 7/20 0.55
MAOA P21397 3/20 0.50
MAOB P27338 3/20 0.50
SLC6A2 P23975 2/20 0.48
SLC6A3 Q01959 2/20 0.48
HTR1A P08908 1/20 0.48
SLC6A4 P31645 1/20 0.48
TSHR P16473 1/20 0.43
FFAR1 O14842 1/20 0.43
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
PTGS1 P23219 1/20 0.42
CYP2C19 P33261 1/20 0.42
PTGS2 P35354 1/20 0.42
HIF1A Q16665 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
ALOX5AP P20292 1/20 0.41
FEN1 P39748 1/20 0.41
MAPT P10636 2/20 0.41
L3MBTL1 Q9Y468 2/20 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
SCHEMBL14882717 0.90 KDM1A (0.60) KDM1AMAOAMAOBSLC6A2SLC6A3
SCHEMBL29216487 0.85 KDM1A (0.50) KDM1AMAOAMAOBSLC6A2SLC6A3
SCHEMBL25430153 0.83 KDM1A (0.48) KDM1AMAOAMAOBSLC6A2SLC6A3
SCHEMBL21647646 0.81 KDM1A (0.43) KDM1AMAOAMAOBSLC6A2SLC6A3
SCHEMBL31266006 0.81 LIPE (0.53) KDM1AMAOAMAOBSLC6A2SLC6A3
SCHEMBL16033831 0.81 KDM1A (0.47) KDM1AMAOAMAOBSLC6A2SLC6A3
SCHEMBL3176483 0.81 KDM1A (0.50) KDM1AMAOAMAOBSLC6A2SLC6A3
SCHEMBL1766179 0.81 MAPT (0.56) KDM1AMAOAMAOBSLC6A2SLC6A3
SCHEMBL31266173 0.81 KDM1A (0.53) KDM1AMAOAMAOBSLC6A2SLC6A3
SCHEMBL25359554 0.81 KDM1A (0.49) KDM1AMAOAMAOBSLC6A2SLC6A3

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
US-5849959-A Derivatives of 2, 3, 6-trifluorophenols and a process for their preparation CLARIANT GMBH (DE) 1998-12-15 US disclosed