SCHEMBL8319186

SCHEMBL8319186

COC(=O)CN(C(N)=O)c1cc(F)ccc1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.40
▸ MAPT P10636 5/20 0.40
▸ ATM Q13315 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ SNCA P37840 1/20 0.39
▸ HTT P42858 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ PKM P14618 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ RAB9A P51151 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
SCHEMBL8322748 0.85 ALDH1A1 (0.37) ALDH1A1MAPTL3MBTL1SMN1; SMN2MAPK1
SCHEMBL31042134 0.84 ATM (0.43) ALDH1A1MAPTATMTDP1SNCA
SCHEMBL8317675 0.77 ALDH1A1 (0.42) ALDH1A1MAPTATMTDP1SNCA
SCHEMBL28575301 0.74 ATM (0.41) ALDH1A1MAPTATMTDP1SNCA
SCHEMBL29676432 0.74 ATM (0.41) ALDH1A1MAPTATMTDP1SNCA
SCHEMBL1028874 0.72 PDGFRB (0.56) ALDH1A1MAPTATMTDP1SNCA
SCHEMBL31083656 0.71 KMT2A (0.46) ALDH1A1MAPTATMTDP1SNCA
SCHEMBL25314269 0.70 CHEK1 (0.47) ALDH1A1MAPTATMTDP1SNCA
SCHEMBL8876679 0.70 ALDH1A1 (0.65) ALDH1A1MAPTTDP1HTTL3MBTL1
SCHEMBL9687422 0.70 TDP1 (0.51) ALDH1A1MAPTATMTDP1SNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5883282-A UREA CHEMICAL INTERMEDIATES; RICE AMERICAN CYANAMID COMPANY (US) 1999-03-16 — — US disclosed
US-5670641-A 3-(3-aryloxyphenyl)-1-(substituted methyl)-S-triazine-2,4,6-oxo or thiotrione herbicidal agents AMERICAN CYANAMID COMPANY (US) 1997-09-23 — — US disclosed
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