SCHEMBL15517005

SCHEMBL15517005

Fc1cc([C]2CC2)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.43
PTGS1 P23219 1/20 0.43
KMO O15229 2/20 0.40
EGLN2 Q96KS0 1/20 0.39
AHR P35869 1/20 0.39
GRM2 Q14416 2/20 0.36
SIRT1 Q96EB6 1/20 0.36
SLC6A3 Q01959 2/20 0.36
ERCC5 P28715 1/20 0.36
FEN1 P39748 1/20 0.36
ABL1 P00519 1/20 0.36
FFAR1 O14842 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.34
CYP11B1 P15538 3/20 0.33
CYP11B2 P19099 3/20 0.33
NISCH Q9Y2I1 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL15516729 0.91 PTGS2 (0.41) PTGS2PTGS1KMOEGLN2AHR
SCHEMBL19993855 0.90 SLC6A3 (0.40) PTGS2PTGS1KMOEGLN2AHR
SCHEMBL29993075 0.83 AHR (0.55) PTGS2PTGS1KMOEGLN2AHR
SCHEMBL15517645 0.82 NISCH (0.49) PTGS2PTGS1KMOAHRNISCH
SCHEMBL21268669 0.78 NOTUM (0.42) PTGS2PTGS1KMOCYP11B1CYP11B2
SCHEMBL9870874 0.78 AHR (0.65) PTGS2PTGS1AHRSLC6A3SLC6A2
SCHEMBL12497411 0.77 SIRT1 (0.40) PTGS2PTGS1KMOSIRT1SLC6A3
SCHEMBL31067094 0.74 AHR (0.46) PTGS2PTGS1KMOEGLN2AHR
SCHEMBL15516726 0.74 PTGS2 (0.51) PTGS2PTGS1KMOSLC6A3NISCH
SCHEMBL3022768 0.73 DAPK3 (0.45) PTGS2PTGS1GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2887802-A2 METHODS OF SOIL PEST CONTROL Syngenta Participations AG (CH) 2015-07-01 EP disclosed
WO-2014029708-A1 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 WO disclosed
WO-2014029706-A2 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 WO disclosed
WO-2014029710-A2 METHODS OF SOIL PEST CONTROL SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 WO disclosed
WO-2014029707-A1 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 WO disclosed
WO-2014019609-A1 METHODS OF PEST CONTROL IN SOYBEAN SYNGENTA PARTICIPATIONS AG (CH) 2014-02-06 WO disclosed