SCHEMBL16585564

SCHEMBL16585564

O=C(N[C@H]1CC[C@H]1c1cccc2c(F)cccc12)c1ccccc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 5/20 0.47
▸ TAS1R3 Q7RTX0 2/20 0.47
▸ TAS1R1 Q7RTX1 2/20 0.47
▸ TAS1R2 Q8TE23 2/20 0.47
▸ PPIA P62937 2/20 0.44
▸ LMNA P02545 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ PTGS1 P23219 1/20 0.40
▸ DPP4 P27487 3/20 0.38
▸ DPP7 Q9UHL4 3/20 0.38
▸ KCNK3 O14649 1/20 0.38
▸ KCNK9 Q9NPC2 1/20 0.38

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
SCHEMBL16585567 1.00 HCRTR1 (0.47) HCRTR1TAS1R3TAS1R1TAS1R2PPIA
SCHEMBL16585565 1.00 HCRTR1 (0.47) HCRTR1TAS1R3TAS1R1TAS1R2PPIA
SCHEMBL19771732 0.89 TAS1R3 (0.51) HCRTR1TAS1R3TAS1R1TAS1R2PPIA
SCHEMBL16392371 0.89 TAS1R3 (0.51) HCRTR1TAS1R3TAS1R1TAS1R2PPIA
SCHEMBL17598751 0.87 HCRTR1 (0.52) HCRTR1TAS1R3TAS1R1TAS1R2PPIA
SCHEMBL17799693 0.83 TAS1R3 (0.47) HCRTR1TAS1R3TAS1R1TAS1R2PPIA
SCHEMBL17598752 0.79 HCRTR1 (0.51) HCRTR1TAS1R3TAS1R1TAS1R2PPIA
SCHEMBL15295032 0.78 HCRTR1 (0.45) HCRTR1TAS1R3TAS1R1TAS1R2PPIA
SCHEMBL16451640 0.78 HCRTR1 (0.45) HCRTR1TAS1R3TAS1R1TAS1R2PPIA
SCHEMBL16451641 0.78 HCRTR1 (0.45) HCRTR1TAS1R3TAS1R1TAS1R2PPIA

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
WO-2015040141-A1 CYCLOBUTYLCARBOXAMIDES AS NEMATICIDES SYNGENTA PARTICIPATIONS AG (CH) 2015-03-26 — — WO disclosed
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