SCHEMBL8565558

SCHEMBL8565558

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.40
PTGER1 P34995 1/20 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
SMN1; SMN2 Q16637 2/20 0.39
RAB9A P51151 1/20 0.39
PPIA P62937 2/20 0.38
CCR5 P51681 1/20 0.37
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
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35

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) MRGPRX4PTGER1RXRARXRBRXRG
SCHEMBL8563160 0.88 MRGPRX4 (0.40) MRGPRX4PTGER1RXRARXRBRXRG
SCHEMBL8563287 0.84 LTA4H (0.40) MRGPRX4PTGER1RXRARXRBRXRG
SCHEMBL20756090 0.81 RXRA (0.54) MRGPRX4RXRARXRBRXRGLTA4H
SCHEMBL8557138 0.80 MRGPRX4 (0.44) MRGPRX4PTGER1RXRARXRBRXRG
SCHEMBL20639243 0.76 MRGPRX4 (0.45) MRGPRX4PTGER1RXRARXRBRXRG
SCHEMBL3726426 0.73 PTGER1 (0.54) MRGPRX4PTGER1RXRARXRBRXRG
SCHEMBL30955958 0.73 PTGER1 (0.54) MRGPRX4PTGER1RXRARXRBRXRG
SCHEMBL8558640 0.72 MAOB (0.42) MRGPRX4RXRARXRBRXRGSMN1; SMN2
SCHEMBL18893896 0.72 MRGPRX4 (0.49) MRGPRX4PTGER1RXRARXRBRXRG

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