SCHEMBL6710116

SCHEMBL6710116

O=C(Nc1ccc(Br)cc1-c1noc(=O)[nH]1)c1noc2cc(NS(=O)(=O)c3ccccc3)ccc12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR27 Q9NS67 4/20 0.40
AVPR2 P30518 1/20 0.40
HIF1A Q16665 5/20 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
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
KDM4E B2RXH2 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
SLC6A3 Q01959 1/20 0.36
MAPT P10636 1/20 0.36
ROCK1 Q13464 1/20 0.36
ACHE P22303 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
SCHEMBL6708537 0.94 ALDH1A1 (0.41) GPR27AVPR2HIF1AGRIK1SLC10A2
SCHEMBL6707834 0.92 ALDH1A1 (0.39) GPR27AVPR2GRIK1SLC10A2SLC10A1
SCHEMBL6711834 0.91 HIF1A (0.46) GPR27AVPR2HIF1AGRIK1ALDH1A1
SCHEMBL6710092 0.88 GRIK1 (0.39) HIF1AGRIK1ALDH1A1MAPTROCK1
SCHEMBL6708931 0.88 GRIK1 (0.37) HIF1AGRIK1ROCK1
SCHEMBL6709849 0.88 GPR27 (0.41) GPR27AVPR2HIF1AALDH1A1KDM4E
SCHEMBL6714102 0.87 GPR27 (0.42) GPR27AVPR2HIF1AGRIK1SLC10A2
SCHEMBL6709254 0.86 GPR27 (0.37) GPR27AVPR2HIF1ASLC10A2SLC10A1
SCHEMBL6713213 0.86 MEN1 (0.39) GPR27AVPR2GRIK1SLC10A2SLC10A1
SCHEMBL6710206 0.85 MAOB (0.37) HIF1AGRIK1

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 GPR27 1616/4885AVPR2 4048/4885HIF1A 296/4885

“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.