SCHEMBL15516979

SCHEMBL15516979

Clc1cc(C2CC2)ccc1Br

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC6A2 P23975 9/20 0.41
SLC6A4 P31645 9/20 0.41
SLC6A3 Q01959 9/20 0.41
CYP2D6 P10635 8/20 0.41
KCNH2 Q12809 7/20 0.41
SMURF2 Q9HAU4 1/20 0.36
SMURF1 Q9HCE7 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
MAPT P10636 1/20 0.34
CHRNA3 P32297 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
SCHEMBL15517597 0.92 SLC6A2 (0.46) MEN1LMNAHPGDALOX15ALOX12
SCHEMBL24524132 0.85 NPC1 (0.51) MEN1LMNAHPGDALOX15ALOX12
SCHEMBL16399374 0.79 ESR2 (0.37) KCNH2
SCHEMBL9870878 0.79 SLC6A2 (0.58) MEN1KMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL2511220 0.78 ESR2 (0.33) KCNH2
SCHEMBL27332849 0.77 MEN1 (0.38) MEN1LMNAHPGDALOX15ALOX12
SCHEMBL3786279 0.76 SLC6A2 (0.42) MEN1KMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL12609599 0.75 GSTO1 (0.45) MEN1LMNAHPGDALOX15ALOX12
SCHEMBL12609600 0.75 GSTO1 (0.45) MEN1LMNAHPGDALOX15ALOX12
SCHEMBL16958236 0.74 ESR2 (0.33) KCNH2

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 5 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-2014029710-A2 METHODS OF SOIL PEST CONTROL 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-2014019609-A1 METHODS OF PEST CONTROL IN SOYBEAN SYNGENTA PARTICIPATIONS AG (CH) 2014-02-06 WO disclosed