SCHEMBL5132229

SCHEMBL5132229

O=c1c2cc(O)ccc2n2cnc3ccc(NCCCN4CCOCC4)c1c32

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 15/20 0.67
SMARCA2 P51531 2/20 0.66
NSD2 O96028 1/20 0.66
NQO1 P15559 2/20 0.65
KEAP1 Q14145 1/20 0.64
NFE2L2 Q16236 1/20 0.64
MITF O75030 1/20 0.45
RAD52 P43351 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL5132250 0.95 NQO2 (0.67) NQO2SMARCA2NSD2NQO1KEAP1
SCHEMBL14291793 0.91 NQO2 (0.69) NQO2SMARCA2NSD2NQO1KEAP1
SCHEMBL13526702 0.86 NQO2 (0.70) NQO2SMARCA2NSD2NQO1KEAP1
SCHEMBL13526651 0.85 NQO2 (0.69) NQO2SMARCA2NSD2NQO1KEAP1
SCHEMBL13526710 0.85 NQO2 (0.70) NQO2SMARCA2NSD2NQO1KEAP1
SCHEMBL13526629 0.84 NQO2 (0.67) NQO2SMARCA2NSD2NQO1KEAP1
SCHEMBL13526632 0.83 NQO2 (0.69) NQO2SMARCA2NSD2NQO1KEAP1
SCHEMBL13526639 0.83 NQO2 (0.66) NQO2SMARCA2NSD2NQO1KEAP1
SCHEMBL7220854 0.80 NQO2 (0.71) NQO2SMARCA2NSD2NQO1KEAP1
SCHEMBL13526642 0.80 NQO2 (1.00) NQO2SMARCA2NSD2NQO1KEAP1

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
US-20100016300-A1 Imidazoacridine Compounds for Treating FLT3-Mediated Disorders XANTHUS PHARMACEUTICALS, INC. 2010-01-21 US disclosed
US-20100016300-A1 Imidazoacridine Compounds for Treating FLT3-Mediated Disorders XANTHUS PHARMACEUTICALS, INC. 2010-01-21 US disclosed
WO-2008016661-A2 MORPHOLINO COMPOUNDS FOR TREATING INFLAMMATORY AND DEMYELINATING DISEASES AND CANCERS XANTHUS PHARMACEUTICALS, INC. (US) 2008-02-07 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-20100016300-A1 Imidazoacridine Compounds for Treating FLT3-Mediated Disorders FLT3, CSF3R, ABL1 NQO2 616/4885SMARCA2 1943/4885NSD2 1552/4885

“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.