SCHEMBL2334759

SCHEMBL2334759

[CH2]n1c(-c2cc(C(F)(F)F)ccn2)noc1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.39
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38
PLAT P00750 1/20 0.35
ADRB1 P08588 1/20 0.34
EGLN2 Q96KS0 1/20 0.34
SYK P43405 2/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
P2RX7 Q99572 2/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
FAAH O00519 1/20 0.32
CES1 P23141 1/20 0.32
CYP17A1 P05093 1/20 0.32
PTGS2 P35354 2/20 0.32
MAT2A P31153 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL2334760 0.84 NPSR1 (0.42) NPSR1NOS3NOS2PLATADRB1
SCHEMBL2332470 0.77 NPSR1 (0.35) NPSR1NOS3NOS2PLATHCRTR1
SCHEMBL2336317 0.77 NPSR1 (0.37) NPSR1NOS3NOS2PLATSYK
SCHEMBL2335764 0.77 NPSR1 (0.37) NPSR1NOS3NOS2SYKHCRTR1
SCHEMBL2338354 0.77 NPSR1 (0.35) NPSR1NOS3NOS2PLATADRB1
SCHEMBL2333905 0.76 NPSR1 (0.39) NPSR1NOS3NOS2PLATSYK
SCHEMBL2341812 0.76 ALDH1A1 (0.49) NPSR1FAAHCES1ALDH1A1GAA
SCHEMBL2338895 0.76 GRIN1 (0.40) PLATHCRTR1HCRTR2P2RX7CYP17A1
SCHEMBL2336622 0.75 ALDH1A1 (0.39) NPSR1NOS3NOS2PLATSYK
SCHEMBL2340988 0.75 SYK (0.40) PLATSYKHCRTR1HCRTR2P2RX7

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
EP-2215086-B1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST SUMITOMO CHEMICAL CO (JP) 2011-08-24 EP disclosed