SCHEMBL19976646

SCHEMBL19976646

CC(NC(=O)c1ccccc1C(F)(F)F)C(=O)c1ncc(Br)cc1Br

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
CTSS P25774 5/20 0.42
CTSK P43235 4/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
ABL1 P00519 1/20 0.38
SRC P12931 1/20 0.38
POLB P06746 1/20 0.38
HCRTR1 O43613 1/20 0.38
PTPRC P08575 1/20 0.38
KCNK3 O14649 3/20 0.38
KCNK9 Q9NPC2 3/20 0.38
PTGS1 P23219 1/20 0.37
RECQL P46063 1/20 0.37
PTGES O14684 1/20 0.37
F2R P25116 1/20 0.36

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
SCHEMBL19975808 0.90 LMNA (0.44) LMNAGAACTSSCTSKSMN1; SMN2
SCHEMBL19975804 0.82 CTSS (0.46) LMNAGAACTSSCTSKABL1
SCHEMBL19976644 0.80 CTSS (0.47) LMNAGAACTSSCTSKABL1
SCHEMBL16711830 0.78 LMNA (0.47) LMNAGAASMN1; SMN2KCNK3KCNK9
SCHEMBL28559185 0.73 LMNA (0.58) LMNAGAACTSSCTSKSMN1; SMN2
SCHEMBL16711717 0.72 KCNK3 (0.43) LMNAGAASMN1; SMN2ABL1SRC
SCHEMBL16711718 0.72 KCNK3 (0.43) LMNAGAASMN1; SMN2ABL1SRC
SCHEMBL16711960 0.72 KCNK3 (0.43) LMNAGAASMN1; SMN2ABL1SRC
SCHEMBL13761361 0.71 LMNA (0.64) LMNAGAACTSSCTSKSMN1; SMN2
SCHEMBL19975807 0.70 LMNA (0.45) LMNAGAASMN1; SMN2ABL1SRC

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-9920046-B2 Oxime-substituted amide compound and pest control agent NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-03-20 US disclosed