SCHEMBL6710140

SCHEMBL6710140

N#Cc1ccc(NC(=O)c2noc3cc(O)ccc23)c(-c2noc(=O)[nH]2)c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.39
ESR2 Q92731 4/20 0.39
HIF1A Q16665 7/20 0.35
HSP90AA1 P07900 1/20 0.33
ROCK1 Q13464 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
GRIK1 P39086 1/20 0.32
XDH P47989 1/20 0.32
SLC22A12 Q96S37 1/20 0.32

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
SCHEMBL6711854 0.90 HIF1A (0.34) HIF1AROCK1TP53POLBMAPT
SCHEMBL6713307 0.90 HIF1A (0.41) HIF1AGRIK1
SCHEMBL6714271 0.89 HIF1A (0.48) HIF1AROCK1
SCHEMBL6709953 0.88 HIF1A (0.43) HIF1AROCK1
SCHEMBL6709183 0.88 MAPT (0.44) HIF1ATP53POLBMAPT
SCHEMBL6708927 0.87 GRIK1 (0.41) ESR1ESR2HIF1AHSP90AA1ROCK1
SCHEMBL6711918 0.86 HIF1A (0.36) HIF1ATP53POLBMAPT
SCHEMBL6710484 0.86 HIF1A (0.46) ESR1ESR2HIF1AHSP90AA1ROCK1
SCHEMBL6713401 0.85 TNIK (0.36) HIF1AROCK1TP53POLBMAPT
SCHEMBL6707723 0.84 GRIK1 (0.39) HIF1AROCK1TP53POLBMAPT

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 ESR1 237/4885ESR2 1251/4885HIF1A 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.