SCHEMBL9017980

SCHEMBL9017980

NC(=O)c1cnccc1C(F)(F)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.53
SIRT3 Q9NTG7 2/20 0.53
KDM4E B2RXH2 2/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4C Q9H3R0 2/20 0.42
MEN1 O00255 1/20 0.42
KDM6B O15054 1/20 0.42
KDM4A O75164 1/20 0.42
THRB P10828 1/20 0.42
KDM4D Q6B0I6 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41
ADORA3 P0DMS8 1/20 0.40
TSHR P16473 1/20 0.40
MC4R P32245 1/20 0.40
ADRA1A P35348 1/20 0.40

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
SCHEMBL30271093 0.87 SIRT3 (0.55) TDP1SIRT3KDM4EMAPTALDH1A1
SCHEMBL1966341 0.87 SIRT3 (0.55) TDP1SIRT3KDM4EMAPTALDH1A1
Methane SCHEMBL27522509 0.86 SIRT3 (0.53) TDP1SIRT3KDM4EMAPTALDH1A1
SCHEMBL3934372 0.85 KDM4C (0.48) TDP1SIRT3KDM4EMAPTALDH1A1
SCHEMBL9018018 0.84 SIRT3 (0.51) TDP1SIRT3KDM4EMAPTALDH1A1
SCHEMBL9017969 0.84 SIRT3 (0.51) TDP1SIRT3KDM4EMAPTALDH1A1
SCHEMBL9017991 0.80 SIRT3 (0.55) TDP1SIRT3KDM4EMAPTALDH1A1
SCHEMBL4043333 0.76 TDP1 (0.50) TDP1SIRT3KDM4EMAPTALDH1A1
SCHEMBL31144930 0.76 TDP1 (0.50) TDP1SIRT3KDM4EMAPTALDH1A1
SCHEMBL1330970 0.74 TDP1 (0.67) TDP1SIRT3KDM4EMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0580374-B1 Pyridine amides and their salts, processes for their production and pesticidal compositions containing them ISHIHARA SANGYO KAISHA (JP) 1996-01-03 EP disclosed
US-5360806-A Insecticides ISHIHARA SANGYO KAISHA LTD. (JP) 1994-11-01 US disclosed
EP-0580374-A1 Pyridine amides and their salts, processes for their production and pesticidal compositions containing them ISHIHARA SANGYO KAISHA, LTD. (JP) 1994-01-26 EP disclosed