SCHEMBL8633367

SCHEMBL8633367

Clc1cc(OCc2cccc(Oc3ccnc(Cl)c3)n2)ccn1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.43
KCNH2 Q12809 1/20 0.42
GRM5 P41594 3/20 0.42
MRGPRX4 Q96LA9 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
PDE10A Q9Y233 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.35
MAP4K4 O95819 1/20 0.35
FFAR1 O14842 1/20 0.35
GPBAR1 Q8TDU6 3/20 0.34
CYSLTR1 Q9Y271 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL8628556 0.90 GRM5 (0.47) PPARGKCNH2GRM5MRGPRX4PDE10A
SCHEMBL8694570 0.90 GRM5 (0.43) PPARGKCNH2GRM5MRGPRX4L3MBTL1
SCHEMBL8692569 0.90 PPARG (0.42) PPARGKCNH2GRM5MRGPRX4L3MBTL1
SCHEMBL8627523 0.88 MAPT (0.45) PPARGKCNH2GRM5MRGPRX4L3MBTL1
SCHEMBL8629313 0.88 MAPT (0.45) PPARGKCNH2GRM5MRGPRX4L3MBTL1
SCHEMBL8630455 0.87 L3MBTL1 (0.37) PPARGKCNH2GRM5L3MBTL1MAP4K4
SCHEMBL8627197 0.86 RECQL (0.42) PPARGGRM5L3MBTL1MAP4K4CYP1A2
SCHEMBL8721109 0.85 F2 (0.44) PPARGGRM5L3MBTL1MAP4K4CYP1A2
SCHEMBL8721952 0.79 PTGER1 (0.44) PPARGGRM5CYP2C19
SCHEMBL8785419 0.78 KMT2A (0.41) PPARGGRM5

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792872-A2 2,6-substituted pyridine derivatives, their preparation and their use as herbicidal agents American Cyanamid Company (US) 1997-09-03 EP claimed
US-5807804-A CONTROLLING WEEDS AMERICAN CYANAMID COMPANY (US) 1998-09-15 US disclosed
US-5710106-A Substituted pyridine herbicidal agents AMERICAN CYANAMID COMPANY (US) 1998-01-20 US disclosed
EP-0792872-A2 2,6-substituted pyridine derivatives, their preparation and their use as herbicidal agents American Cyanamid Company (US) 1997-09-03 EP disclosed