SCHEMBL9428146

SCHEMBL9428146

CCS(=O)(=O)Nc1cccc(-n2nc(C)n(C(F)F)c2=O)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPOX P50336 1/20 0.45
AR P10275 5/20 0.45
BRD4 O60885 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
BRDT Q58F21 1/20 0.40
PARP1 P09874 1/20 0.38
ATM Q13315 1/20 0.38
HTR1A P08908 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA1A P35348 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
SCHEMBL29575134 0.88 PPOX (0.55) PPOXBRD4SMN1; SMN2
SCHEMBL5187233 0.85 PPOX (0.47) PPOXARSMN1; SMN2
SCHEMBL9428283 0.81 PPOX (0.49) PPOXARBRD4
SCHEMBL9427767 0.75 PPOX (0.44) PPOXMEN1KMT2A
SCHEMBL29575421 0.75 PPOX (0.44) PPOXMEN1KMT2A
SCHEMBL29575373 0.75 PPOX (0.45) PPOX
SCHEMBL8660425 0.74 ROCK2 (0.47) PPOX
SCHEMBL29574794 0.69 PPOX (0.72) PPOX
SCHEMBL7067774 0.67 PPOX (0.47) PPOXSMN1; SMN2KMT2A
SCHEMBL29539574 0.66 BRD4 (0.53) ARBRD4SMN1; SMN2BRDT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5294595-A 2-(2-Halo-5-sulfoamido-phenyl),5-oxo-1,2,4-triazoles and an additional herbicide with a carrier FMC CORPORATION (US) 1994-03-15 US disclosed
EP-0294375-B1 HERBICIDAL ARYL TRIAZOLINONES FMC Corporation (US) 1993-08-18 EP disclosed
US-5214154-A Herbicidal aryl triazolinones FMC CORPORATION (US) 1993-05-25 US disclosed
US-5174809-A Herbicidal aryl triazolinones FMC CORPORATION (US) 1992-12-29 US disclosed
US-5041155-A Preemergence herbicide mixture for controlling grass; for use with soybeans, corn or sugar cane FMC CORPORATION (US) 1991-08-20 US disclosed
US-4818275-A PREEMERGENCE FMC CORPORATION (US) 1989-04-04 US disclosed
EP-0294375-A1 HERBICIDAL ARYL TRIAZOLINONES. FMC CORP (US) 1988-12-14 EP disclosed
EP-0294375-A4 HERBICIDAL ARYL TRIAZOLINONES. FMC CORP (US) 1988-10-20 EP disclosed
WO-1987003782-A1 HERBICIDAL ARYL TRIAZOLINONES FMC CORPORATION (US) 1987-07-02 WO disclosed