SCHEMBL6680409

SCHEMBL6680409

[O-][n+]1nc(CCO)nc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.39
BLM P54132 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MMP14 P50281 2/20 0.39
CASP6 P55212 2/20 0.39
KDM4E B2RXH2 4/20 0.36
MAPK1 P28482 2/20 0.36
ALDH1A1 P00352 3/20 0.33
GAA P10253 2/20 0.33
RAD52 P43351 2/20 0.33
MITF O75030 1/20 0.33
LMNA P02545 1/20 0.33
TTR P02766 1/20 0.33
GLA P06280 1/20 0.33
RAB9A P51151 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 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
SCHEMBL5461511 0.90 POLB (0.37) POLBBLMMEN1KMT2AMMP14
SCHEMBL6674365 0.80 CRHBP (0.39) POLBMEN1KMT2AKDM4EMAPK1
SCHEMBL6679474 0.80 TAAR1 (0.37) POLBKMT2AALDH1A1RAD52RAB9A
SCHEMBL6673749 0.79 CRHBP (0.37) POLBBLMMEN1KMT2AMMP14
SCHEMBL6679523 0.77 KDM4E (0.38) POLBMEN1KMT2AKDM4EMAPK1
Hydrochloric Acid SCHEMBL6674090 0.76 RAD52 (0.40) POLBKMT2AKDM4EMAPK1ALDH1A1
SCHEMBL6365368 0.74 POLB (0.49) POLBBLMMEN1KMT2AMMP14
SCHEMBL14428391 0.73 TP53 (0.35) POLBMEN1KMT2AMAPTATM
SCHEMBL5457433 0.73 CRHBP (0.37) POLBBLMMEN1KMT2AMMP14
Hydrochloric Acid SCHEMBL6680306 0.72 HRH3 (0.44)

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
EP-1468688-A2 Benzoazine mono-N-oxides and benzoazine 1,4 dioxides and compositions therefrom for the therapeutic use in cancer treatments Auckland Uniservices Limited (NZ) 2004-10-20 EP claimed
US-20040192686-A1 Benzoazine mono-N-oxides and benzoazine 1,4 dioxides and compositions therefrom for the therapeutic use in cancer treatments AUCKLAND UNISERVICES LIMITED (NZ) 2004-09-30 US claimed
EP-1468688-A2 Benzoazine mono-N-oxides and benzoazine 1,4 dioxides and compositions therefrom for the therapeutic use in cancer treatments Auckland Uniservices Limited (NZ) 2004-10-20 EP disclosed
US-20040192686-A1 Benzoazine mono-N-oxides and benzoazine 1,4 dioxides and compositions therefrom for the therapeutic use in cancer treatments AUCKLAND UNISERVICES LIMITED (NZ) 2004-09-30 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-20040192686-A1 Benzoazine mono-N-oxides and benzoazine 1,4 dioxides and compositions therefrom for the therapeutic use in cancer treatments NPM1, DUOX1, NOX5 POLB 2984/4885BLM 3564/4885MEN1 2339/4885

“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.