SCHEMBL19771732

SCHEMBL19771732

O=C(NC1CC[C@@H]1c1cccc(F)c1F)c1ccccc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 2/20 0.51
▸ TAS1R1 Q7RTX1 2/20 0.51
▸ TAS1R2 Q8TE23 2/20 0.51
▸ HCRTR1 O43613 1/20 0.47
▸ PPIA P62937 2/20 0.46
▸ LMNA P02545 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ PTGS1 P23219 1/20 0.42
▸ EPHX2 P34913 1/20 0.40
▸ KCNK3 O14649 1/20 0.39
▸ KCNK9 Q9NPC2 1/20 0.39
▸ DPP4 P27487 3/20 0.39
▸ DPP7 Q9UHL4 3/20 0.39
▸ KAT6A Q92794 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ TP53 P04637 1/20 0.37

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
SCHEMBL16392371 1.00 TAS1R3 (0.51) TAS1R3TAS1R1TAS1R2HCRTR1PPIA
SCHEMBL16585564 0.89 HCRTR1 (0.47) TAS1R3TAS1R1TAS1R2HCRTR1PPIA
SCHEMBL16585567 0.89 HCRTR1 (0.47) TAS1R3TAS1R1TAS1R2HCRTR1PPIA
SCHEMBL16585565 0.89 HCRTR1 (0.47) TAS1R3TAS1R1TAS1R2HCRTR1PPIA
SCHEMBL17598751 0.87 HCRTR1 (0.52) TAS1R3TAS1R1TAS1R2HCRTR1PPIA
SCHEMBL17799693 0.85 TAS1R3 (0.47) TAS1R3TAS1R1TAS1R2HCRTR1PPIA
SCHEMBL16451641 0.80 HCRTR1 (0.45) TAS1R3TAS1R1TAS1R2HCRTR1PPIA
SCHEMBL15295033 0.80 HCRTR1 (0.45) TAS1R3TAS1R1TAS1R2HCRTR1PPIA
SCHEMBL16451640 0.80 HCRTR1 (0.45) TAS1R3TAS1R1TAS1R2HCRTR1PPIA
SCHEMBL15295032 0.80 HCRTR1 (0.45) TAS1R3TAS1R1TAS1R2HCRTR1PPIA

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-9867371-B2 4-membered ring carboxamides used as nematicides SYNGENTA PARTICIPATIONS AG (CH) 2018-01-16 — — US disclosed
Send feedback