SCHEMBL12779405

SCHEMBL12779405

FC(F)(F)c1ccc(Cl)cc1/C(=N/OCc1ccc(-c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 5/20 0.39
MRGPRX4 Q96LA9 2/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
USP1 O94782 3/20 0.37
WDR48 Q8TAF3 3/20 0.37
GFER P55789 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SERPINE1 P05121 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
PTGER1 P34995 2/20 0.35
CYP2C9 P11712 1/20 0.35
PPARG P37231 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
SCHEMBL12779257 0.94 MRGPRX4 (0.41) S1PR1MRGPRX4KMT2AMEN1MAPT
SCHEMBL12779267 0.93 MRGPRX4 (0.44) S1PR1MRGPRX4KMT2AGFERSMN1; SMN2
SCHEMBL12779127 0.91 PPARG (0.41) S1PR1MRGPRX4KMT2AGFERSMN1; SMN2
SCHEMBL12779261 0.90 MRGPRX4 (0.38) S1PR1MRGPRX4KMT2AGFERSMN1; SMN2
SCHEMBL12779299 0.89 MRGPRX4 (0.47) MRGPRX4KMT2AGFERSMN1; SMN2NPC1
SCHEMBL12779391 0.88 ALDH1A1 (0.41) S1PR1MRGPRX4KMT2AMEN1MAPT
SCHEMBL12779393 0.88 MRGPRX4 (0.40) S1PR1MRGPRX4KMT2AUSP1WDR48
SCHEMBL12779351 0.87 NPC1 (0.51) MRGPRX4KMT2AMEN1MAPTUSP1
SCHEMBL12779356 0.86 MRGPRX4 (0.48) S1PR1MRGPRX4MAPTSMN1; SMN2NPC1
SCHEMBL12779279 0.85 MRGPRX4 (0.44) MRGPRX4NPC1RAB9A

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-7906538-B2 Parasiticides; nematocides; crop protection SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2011-03-15 US disclosed