SCHEMBL6709874

SCHEMBL6709874

CS(=O)(=O)Nc1ccc2onc(C(=O)Nc3ccc(Br)cc3-c3noc(=O)[nH]3)c2c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.39
HIF1A Q16665 10/20 0.36
CSNK2A1 P68400 1/20 0.35
RARA P10276 1/20 0.35
MAPT P10636 2/20 0.34
ROCK1 Q13464 1/20 0.34
TNIK Q9UKE5 1/20 0.34
PLA2G7 Q13093 2/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL6710092 0.93 GRIK1 (0.39) GRIK1HIF1ACSNK2A1RARAMAPT
SCHEMBL6709902 0.90 HIF1A (0.44) GRIK1HIF1ACSNK2A1RARAROCK1
SCHEMBL6708537 0.88 ALDH1A1 (0.41) GRIK1HIF1AMAPTROCK1MEN1
SCHEMBL6709887 0.88 GRIK1 (0.43) GRIK1HIF1AMAPTROCK1MEN1
SCHEMBL6708048 0.87 TNIK (0.36) HIF1ACSNK2A1RARAMAPTROCK1
SCHEMBL6713213 0.87 MEN1 (0.39) GRIK1MAPTMEN1KMT2ACA12
SCHEMBL6709830 0.86 BRD4 (0.39) GRIK1HIF1AROCK1
SCHEMBL6709880 0.85 TNIK (0.35) HIF1ACSNK2A1MAPTROCK1TNIK
SCHEMBL6708097 0.84 HIF1A (0.43) GRIK1HIF1AMAPTROCK1HPGD
SCHEMBL6707653 0.84 HPGD (0.42) GRIK1HIF1AROCK1HPGD

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 GRIK1 3885/4885HIF1A 296/4885CSNK2A1 4099/4885

“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.