SCHEMBL6709879

SCHEMBL6709879

CN(C)c1ccc2onc(C(=O)Nc3ccc(Cl)cc3-c3noc(=O)[nH]3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 9/20 0.48
GRIK1 P39086 1/20 0.41
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
PDK1 Q15118 1/20 0.37
FAAH O00519 1/20 0.36
F11 P03951 2/20 0.35
KLKB1 P03952 1/20 0.35
GRM5 P41594 1/20 0.35
ROCK1 Q13464 1/20 0.34
CSF1R P07333 1/20 0.34
CMKLR1 Q99788 1/20 0.34
F10 P00742 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
SCHEMBL6714364 0.89 HIF1A (0.45) HIF1AGRIK1HSP90AA1HSP90AB1PDK1
SCHEMBL6710163 0.87 HIF1A (0.43) HIF1AHSP90AA1HSP90AB1PDK1F11
SCHEMBL6711456 0.86 HIF1A (0.46) HIF1AGRIK1F11KLKB1
SCHEMBL6710165 0.86 ALDH1A1 (0.40) HIF1AGRIK1CMKLR1
SCHEMBL6708659 0.86 GRIK1 (0.51) HIF1AGRIK1F11KLKB1GRM5
SCHEMBL6708495 0.86 HIF1A (0.45) HIF1AGRIK1F11KLKB1GRM5
SCHEMBL6713252 0.85 HIF1A (0.61) HIF1AGRIK1ROCK1
SCHEMBL6713334 0.85 HIF1A (0.45) HIF1AHSP90AA1HSP90AB1PDK1FAAH
SCHEMBL6709033 0.85 HIF1A (0.49) HIF1AGRIK1F11KLKB1GRM5
SCHEMBL6709902 0.84 HIF1A (0.44) HIF1AGRIK1F11KLKB1ROCK1

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 HIF1A 296/4885GRIK1 3885/4885HSP90AA1 59/4885

“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.