SCHEMBL6708537

SCHEMBL6708537

O=C(Nc1ccc(Br)cc1-c1noc(=O)[nH]1)c1noc2ccc(NS(=O)(=O)c3ccccc3)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
GPR27 Q9NS67 4/20 0.40
AVPR2 P30518 1/20 0.40
HIF1A Q16665 4/20 0.39
GRIK1 P39086 1/20 0.39
SLC10A2 Q12908 1/20 0.38
SLC10A1 Q14973 1/20 0.38
SLC10A6 Q3KNW5 1/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
BRD4 O60885 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
SLC6A3 Q01959 1/20 0.36

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
SCHEMBL6710116 0.94 GPR27 (0.40) ALDH1A1GPR27AVPR2HIF1AGRIK1
SCHEMBL6713213 0.92 MEN1 (0.39) ALDH1A1GPR27AVPR2GRIK1SLC10A2
SCHEMBL6714102 0.92 GPR27 (0.42) GPR27AVPR2HIF1AGRIK1SLC10A2
SCHEMBL6710483 0.91 HIF1A (0.46) ALDH1A1GPR27AVPR2HIF1AGRIK1
SCHEMBL6709874 0.88 GRIK1 (0.39) HIF1AGRIK1MAPTMEN1KMT2A
SCHEMBL6709830 0.88 BRD4 (0.39) HIF1AGRIK1BRD4ROCK1
SCHEMBL6707931 0.88 GPR27 (0.41) ALDH1A1GPR27AVPR2HIF1AMEN1
SCHEMBL6914244 0.88 MEN1 (0.36) ALDH1A1GPR27GRIK1SLC10A2SLC10A1
SCHEMBL6708097 0.87 HIF1A (0.43) ALDH1A1HIF1AGRIK1MAPTNPSR1
SCHEMBL6708030 0.86 ALDH1A1 (0.39) ALDH1A1GPR27AVPR2HIF1ASLC10A2

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-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 ALDH1A1 123/4885GPR27 1616/4885AVPR2 4048/4885

“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.