SCHEMBL15075518

SCHEMBL15075518

C=C(N(C)C)C(F)(F)Oc1cc(F)c([N+](=O)[O-])cc1N=O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ESPL1 Q14674 1/20 0.31
▸ ATM Q13315 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL17875092 0.87 KMT2A (0.33) ESPL1ATMTDP1
SCHEMBL15076282 0.81 — —
SCHEMBL17875093 0.80 COMT (0.31) TDP1
SCHEMBL15075537 0.75 HTT (0.30) —
SCHEMBL17875097 0.75 GAA (0.43) —
SCHEMBL15056851 0.73 KMT2A (0.36) ESPL1ATMTDP1
SCHEMBL17875095 0.73 SMN1; SMN2 (0.41) —
SCHEMBL19753291 0.66 TDP1 (0.43) ESPL1ATMTDP1
SCHEMBL15056545 0.65 MAPT (0.35) TDP1
SCHEMBL19753290 0.64 MAPT (0.37) ESPL1ATMTDP1

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
WO-2014202589-A1 PROCESS FOR MANUFACTURING 4-PROPARGYLATED AMINO-BENZOXAZINONES BASF SE (DE) 2014-12-24 — — WO disclosed
WO-2013092856-A1 PROCESS FOR MANUFACTURING BENZOXAZINONES BASF SE (DE) 2013-06-27 — — WO disclosed
WO-2013092859-A1 PROCESS FOR MANUFACTURING 4-SUBSTITUTED AMINO-BENZOXAZINONES BASF SE (DE) 2013-06-27 — — WO disclosed
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