SCHEMBL30547697

SCHEMBL30547697

NC(=O)c1cnc2c(F)c(F)ccc2c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 2/20 0.54
STAMBP O95630 1/20 0.54
COPS5 Q92905 1/20 0.54
HPGDS O60760 2/20 0.46
ABCG2 Q9UNQ0 1/20 0.41
NNMT P40261 4/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
VNN1 O95497 2/20 0.39
LCK P06239 1/20 0.39
PARP1 P09874 3/20 0.38
CYP11B2 P19099 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
SIRT3 Q9NTG7 1/20 0.35

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
SCHEMBL7085565 1.00 PSMD14 (0.54) PSMD14STAMBPCOPS5HPGDSABCG2
SCHEMBL29940529 0.85 PSMD14 (0.53) PSMD14STAMBPCOPS5ABCG2VNN1
SCHEMBL2675814 0.85 PSMD14 (0.53) PSMD14STAMBPCOPS5ABCG2VNN1
SCHEMBL29688144 0.81 PSMD14 (0.66) PSMD14STAMBPCOPS5HPGDSPARP1
SCHEMBL19346770 0.81 PSMD14 (0.66) PSMD14STAMBPCOPS5HPGDSPARP1
SCHEMBL29643179 0.80 PSMD14 (0.44) PSMD14STAMBPCOPS5HPGDSNNMT
Butane SCHEMBL7227124 0.79 PSMD14 (0.47) PSMD14ABCG2VNN1
SCHEMBL7220371 0.77 MAOB (0.48) PSMD14SMN1; SMN2
SCHEMBL21358860 0.74 PSMD14 (0.61) PSMD14STAMBPCOPS5HPGDSSMN1; SMN2
SCHEMBL12483271 0.74 ABCG2 (0.40) ABCG2CYP11B2

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
CN-117177963-A Microbiocidal quinoline/quinoxaline isoquinoline derivatives 先正达农作物保护股份公司 2023-12-05 CN disclosed