SCHEMBL6079707

SCHEMBL6079707

COC(=O)c1nc2ccccc2c(O)c1Br

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
ERCC1 P07992 1/20 0.45
FEN1 P39748 1/20 0.45
ERCC4 Q92889 1/20 0.45
STAT3 P40763 1/20 0.44
HIF1A Q16665 1/20 0.44
POLB P06746 2/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
F2 P00734 1/20 0.43
PLAU P00749 1/20 0.43
ELANE P08246 1/20 0.43
RNASEH1 O60930 1/20 0.42
TNKS O95271 1/20 0.42
NPC1 O15118 1/20 0.41

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
SCHEMBL8569494 0.83 MEN1 (0.56) KDM4EMEN1KMT2ASMN1; SMN2ERCC1
SCHEMBL30641227 0.82 KDM4E (0.55) KDM4EMEN1KMT2ASMN1; SMN2ERCC1
SCHEMBL26674806 0.82 KDM4E (0.55) KDM4EMEN1KMT2ASMN1; SMN2ERCC1
SCHEMBL6079815 0.79 CA12 (0.45) KDM4EMEN1KMT2AERCC1FEN1
SCHEMBL28342069 0.79 KDM4E (0.54) KDM4EMEN1KMT2ASMN1; SMN2STAT3
SCHEMBL23440107 0.78 KDM4E (0.46) KDM4EMEN1KMT2ASMN1; SMN2ERCC1
SCHEMBL29966763 0.78 KDM4E (0.46) KDM4EMEN1KMT2ASMN1; SMN2ERCC1
SCHEMBL29866310 0.78 KDM4E (0.46) KDM4EMEN1KMT2ASMN1; SMN2ERCC1
SCHEMBL30617298 0.78 KDM4E (0.42) KDM4EMEN1KMT2ASMN1; SMN2STAT3
SCHEMBL6080471 0.77 ALDH1A1 (0.40) KDM4EMEN1KMT2ASMN1; SMN2ERCC1

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-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 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-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NQO1, NQO2, RECQL KDM4E 1006/4885MEN1 740/4885KMT2A 1384/4885

“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.