SCHEMBL9017978

SCHEMBL9017978

NC(=O)c1cnccc1C(Br)Br

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT3 Q9NTG7 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
KDM4E B2RXH2 3/20 0.41
HTT P42858 1/20 0.41
F7 P08709 1/20 0.40
F3 P13726 1/20 0.40
SARM1 Q6SZW1 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
SIRT6 Q8N6T7 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
SIRT5 Q9NXA8 1/20 0.40
SIRT4 Q9Y6E7 1/20 0.40
MKNK1 Q9BUB5 4/20 0.40
MKNK2 Q9HBH9 4/20 0.40
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
KDM6B O15054 1/20 0.39
KDM4A O75164 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL6215853 0.81 SIRT3 (0.59) SIRT3TDP1KDM4EHTTF7
SCHEMBL4816775 0.81 SIRT3 (0.55) SIRT3TDP1KDM4EHTTF7
SCHEMBL26703728 0.77 KDM4E (0.54) SIRT3TDP1KDM4EHTTALDH1A1
SCHEMBL1330970 0.76 TDP1 (0.67) SIRT3TDP1KDM4EHTTF7
SCHEMBL1687197 0.76 TDP1 (0.67) SIRT3TDP1KDM4EHTTF7
SCHEMBL1379680 0.75 SIRT3 (0.60) SIRT3TDP1KDM4EHTTF7
SCHEMBL1265706 0.75 SIRT3 (1.00) SIRT3TDP1KDM4EHTTF7
SCHEMBL31688820 0.75 SIRT3 (0.60) SIRT3TDP1KDM4EHTTF7
SCHEMBL29682389 0.75 SIRT3 (1.00) SIRT3TDP1KDM4EHTTF7
SCHEMBL16466448 0.74 TDP1 (0.50) SIRT3TDP1KDM4EHTTF7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1044233-C Amide compounds and their salts, processes for their production and pesticidal compositions containing them ISHIHARA SANGYO KAISHA (JP) 1999-07-21 CN disclosed
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