SCHEMBL8960306

SCHEMBL8960306

COC(=O)Oc1cc(F)c(F)cc1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.40
MAPT P10636 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GPR174 Q9BXC1 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
HTT P42858 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
CYP3A4 P08684 2/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP2D6 P10635 1/20 0.38
TTR P02766 1/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL7215856 0.83 HTT (0.41) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL2012345 0.81 L3MBTL1 (0.52) ALDH1A1MAPTKMT2AHTTRAB9A
SCHEMBL29739365 0.80 MAPT (0.39) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL1098698 0.80 MAPT (0.39) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL29661436 0.79 ALDH1A1 (0.50) ALDH1A1MAPTHTTCYP3A4TDP1
SCHEMBL517768 0.79 ALDH1A1 (0.50) ALDH1A1MAPTHTTCYP3A4TDP1
SCHEMBL2968975 0.79 CUL4A (0.42) ALDH1A1MAPTMEN1KMT2AHTT
SCHEMBL2030437 0.79 CUL4A (0.42) ALDH1A1MAPTMEN1KMT2AHTT
SCHEMBL2572480 0.78 HTT (0.43) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL27838026 0.77 RECQL (0.41) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A

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
US-5532208-A HERBICIDES SUMITOMO CHEMICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5366955-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-11-22 US disclosed
EP-0568041-A1 Pyrimidone derivatives and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-03 EP disclosed