SCHEMBL10853799

SCHEMBL10853799

CCOC(=O)CCOP(C)(=O)c1cc(Oc2ccc(OC(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ TTR P02766 1/20 0.42
▸ PPOX P50336 1/20 0.42
▸ PPARA Q07869 3/20 0.38
▸ PPARD Q03181 2/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ FFAR4 Q5NUL3 3/20 0.36
▸ FFAR1 O14842 1/20 0.36
▸ FBP1 P09467 3/20 0.34
▸ SCN9A Q15858 4/20 0.34
▸ POLB P06746 2/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ CACNA1C Q13936 1/20 0.34
▸ SCN5A Q14524 1/20 0.34
▸ LMNA P02545 2/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PPARG P37231 1/20 0.33

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
SCHEMBL11294457 0.90 MEN1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10853792 0.85 TDP1 (0.42) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10858870 0.81 MEN1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11292209 0.79 MEN1 (0.53) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10853087 0.77 MEN1 (0.58) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11294454 0.75 MEN1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11054533 0.75 MEN1 (0.56) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11062686 0.75 MEN1 (0.66) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11410284 0.74 KMT2A (0.48) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10856972 0.74 MEN1 (0.55) TDP1MEN1KMT2ATTRPPOX

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
US-4563310-A HERBICIDES ZOECON CORPORATION (US) 1986-01-07 — — US disclosed
Send feedback