SCHEMBL300188

SCHEMBL300188

CCOC(=O)c1cc(OCCCO)c(OCCCO)cc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
CCR6 P51684 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.48
POLB P06746 2/20 0.48
GALR2 O43603 1/20 0.48
MITF O75030 1/20 0.48
HSP90AA1 P07900 1/20 0.48
HPGD P15428 1/20 0.48
XBP1 P17861 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.44
KMT2A Q03164 2/20 0.43
PKM P14618 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 6/20 0.43
THRB P10828 1/20 0.43
HTT P42858 1/20 0.41
RAB9A P51151 2/20 0.40
PTGER4 P35408 1/20 0.40

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
SCHEMBL1012650 0.88 ALDH1A1 (0.53) ALDH1A1CCR6SMN1; SMN2LMNAPOLB
SCHEMBL264575 0.87 ALDH1A1 (0.48) ALDH1A1CCR6SMN1; SMN2LMNAPOLB
SCHEMBL13168044 0.85 PKM (0.50) ALDH1A1CCR6SMN1; SMN2LMNAPOLB
SCHEMBL7719088 0.84 PKM (0.49) ALDH1A1CCR6SMN1; SMN2LMNAPOLB
SCHEMBL5500527 0.84 HTT (0.53) ALDH1A1CCR6SMN1; SMN2LMNAPOLB
SCHEMBL17854642 0.84 MAPT (0.46) ALDH1A1CCR6SMN1; SMN2LMNAPOLB
SCHEMBL28400061 0.83 POLB (0.52) ALDH1A1SMN1; SMN2LMNAPOLBL3MBTL1
SCHEMBL8263297 0.83 MEN1 (0.55) ALDH1A1CCR6SMN1; SMN2LMNAPOLB
SCHEMBL25040429 0.82 MEN1 (0.46) ALDH1A1CCR6SMN1; SMN2LMNAPOLB
SCHEMBL10102460 0.82 ALDH1A1 (0.46) ALDH1A1CCR6SMN1; SMN2LMNAPOLB

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-8133999-B2 Process for preparation of 6, 7-bis(2-methoxyethoxy) quinazolin-4-one UBE INDUSTRIES, LTD. (JP) 2012-03-13 US disclosed
US-20090253909-A1 PROCESS FOR PREPARATION OF 6, 7-BIS (2-METHOXYETHOXY) QUINAZOLIN-4-ONE UBE INDUSTRIES, LTD. (JP) 2009-10-08 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-20090253909-A1 PROCESS FOR PREPARATION OF 6, 7-BIS (2-METHOXYETHOXY) QUINAZOLIN-4-ONE CYP4F11, OGFR, CYP4B1 ALDH1A1 897/4885CCR6 1372/4885SMN1; SMN2 3228/4885

“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.