SCHEMBL8563160

SCHEMBL8563160

FC(F)(F)c1cc(Oc2ncccn2)c(I)cc1OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.40
RXRA P19793 2/20 0.40
RXRB P28702 2/20 0.40
RXRG P48443 2/20 0.40
LTA4H P09960 1/20 0.40
MAPK14 Q16539 1/20 0.40
CTSS P25774 1/20 0.39
FFAR1 O14842 1/20 0.39
PTGER1 P34995 1/20 0.38
PPIA P62937 2/20 0.38
ALOX5AP P20292 1/20 0.37
S1PR1 P21453 1/20 0.36
AR P10275 1/20 0.36
HTR2C P28335 1/20 0.36
SLC6A4 P31645 1/20 0.36
HTR2B P41595 1/20 0.36

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
SCHEMBL8565675 0.91 LTA4H (0.44) MRGPRX4RXRARXRBRXRGLTA4H
SCHEMBL8565558 0.88 MRGPRX4 (0.40) MRGPRX4RXRARXRBRXRGLTA4H
SCHEMBL8563287 0.82 LTA4H (0.40) MRGPRX4RXRARXRBRXRGLTA4H
SCHEMBL20756090 0.81 RXRA (0.54) MRGPRX4RXRARXRBRXRGLTA4H
SCHEMBL8557138 0.80 MRGPRX4 (0.44) MRGPRX4RXRARXRBRXRGLTA4H
SCHEMBL544693 0.73 MRGPRX4 (0.50) MRGPRX4RXRARXRBRXRGCTSS
SCHEMBL20755877 0.72 FFAR1 (0.57) LTA4HMAPK14FFAR1
SCHEMBL8558640 0.72 MAOB (0.42) MRGPRX4RXRARXRBRXRGAR
SCHEMBL18893896 0.72 MRGPRX4 (0.49) MRGPRX4RXRARXRBRXRGMAPK14
SCHEMBL29937257 0.72 MRGPRX4 (0.49) MRGPRX4RXRARXRBRXRGMAPK14

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-5726128-A Benzyloxypyrimidine derivative, processes for producing the same and herbicidal composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-03-10 US disclosed