SCHEMBL9984176

SCHEMBL9984176

O=c1oc(-c2ccccc2F)nc2c(Cl)cccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.64
C1R P00736 3/20 0.63
APEX1 P27695 1/20 0.59
F7 P08709 3/20 0.58
F3 P13726 3/20 0.58
F10 P00742 2/20 0.58
F2 P00734 2/20 0.58
MAPT P10636 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HTT P42858 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44
PRSS1 P07477 1/20 0.44
CTSG P08311 1/20 0.44
KLK7 P49862 1/20 0.44
KLK14 Q9P0G3 1/20 0.44
KLK5 Q9Y337 1/20 0.44

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
SCHEMBL9985390 0.88 C1R (0.70) ELANEC1RF2MAPTMEN1
SCHEMBL5257723 0.86 C1R (0.58) ELANEC1RF2MAPTMEN1
SCHEMBL16431272 0.84 C1R (0.65) ELANEC1RAPEX1F7F3
SCHEMBL9985296 0.83 ELANE (0.64) ELANEC1RF7F3F2
SCHEMBL9985005 0.83 ELANE (0.64) ELANEC1RAPEX1F2MAPT
SCHEMBL913425 0.82 ELANE (0.69) ELANEC1RAPEX1F7F3
SCHEMBL913925 0.81 C1R (0.60) ELANEC1RAPEX1F7F3
SCHEMBL25054223 0.81 C1R (0.63) ELANEC1RF7F3MAPT
SCHEMBL16431486 0.80 C1R (0.59) ELANEC1RAPEX1F7F3
SCHEMBL9984385 0.80 ELANE (0.66) ELANEC1RMAPTMEN1KMT2A

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-20110319611-A1 BENZOXAZINONE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CHANG GUNG UNIVERSITY (TW) 2011-12-29 US 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-20110319611-A1 BENZOXAZINONE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CYP4X1, CYP2B6, CYP2C19 ELANE 3461/4885C1R 84/4885APEX1 3474/4885

“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.