SCHEMBL1559918

SCHEMBL1559918

COC=Cc1cccc(Br)c1F

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LY96 Q9Y6Y9 1/20 0.34
NFE2L2 Q16236 6/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD11B1 P28845 1/20 0.32
RELA Q04206 2/20 0.31

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
SCHEMBL2393408 1.00 LY96 (0.34) LY96NFE2L2LMNAGAAMAPT
SCHEMBL18954106 0.83 KDM1A (0.31)
SCHEMBL18954104 0.83 KDM1A (0.31)
SCHEMBL1293193 0.81 LY96 (0.36) LY96NFE2L2GAAMAPTHSD11B1
SCHEMBL1245999 0.81 LY96 (0.36) LY96NFE2L2GAAMAPTHSD11B1
SCHEMBL30749709 0.80 LY96 (0.49) LY96NFE2L2HSD11B1
SCHEMBL9261193 0.80 LY96 (0.49) LY96NFE2L2HSD11B1
SCHEMBL9261189 0.80 LY96 (0.49) LY96NFE2L2HSD11B1
SCHEMBL1293024 0.78 NFE2L2 (0.41) LY96NFE2L2MAPT
SCHEMBL1293025 0.78 NFE2L2 (0.41) LY96NFE2L2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017602-B2 N-(2-(2-(5-hydroxy-3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazin-8-yl)ethylamino)ethyl)-3-(phenethoxy)propanamide derivatives, processes for their preparation, pharmaceutical compositions containing them and their use in therapy ASTRAZENECA AB (SE) 2011-09-13 US disclosed
EP-2303873-A1 BENZOXAZINONE DERIVATIVES ACTING AS BETA2-ADRENORECEPTOR AGONIST FOR THE TREATMENT OF RESPIRATORY DISORDERS AstraZeneca AB (SE) 2011-04-06 EP disclosed
US-20100105642-A1 NOVEL COMPOUNDS 409 ASTRAZENECA AB (SE) 2010-04-29 US disclosed
WO-2009154557-A1 BENZOXAZINONE DERIVATIVES ACTING AS BETA2-ADRENORECEPTOR AGONIST FOR THE TREATMENT OF RESPIRATORY DISORDERS ASTRAZENECA AB (SE) 2009-12-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100105642-A1 NOVEL COMPOUNDS 409 GPR119, CYP4B1, CYP4A11 LY96 3839/4885NFE2L2 1953/4885LMNA 3544/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.