SCHEMBL6709953

SCHEMBL6709953

N#Cc1ccc(NC(=O)c2noc3cc(-c4ccccc4)ccc23)c(-c2noc(=O)[nH]2)c1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 9/20 0.43
ROCK1 Q13464 1/20 0.38
ITK Q08881 1/20 0.36
ACLY P53396 1/20 0.35
KAT6A Q92794 1/20 0.34
DHFR P00374 1/20 0.34

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
SCHEMBL6713809 0.93 HIF1A (0.43) HIF1AROCK1ITKACLYKAT6A
SCHEMBL6714271 0.89 HIF1A (0.48) HIF1AROCK1
SCHEMBL6707809 0.88 EPHX2 (0.40) HIF1AROCK1
SCHEMBL6710140 0.88 ESR1 (0.39) HIF1AROCK1
SCHEMBL6710367 0.87 HIF1A (0.47) HIF1AROCK1
SCHEMBL6711854 0.87 HIF1A (0.34) HIF1AROCK1
SCHEMBL6711800 0.87 HIF1A (0.45) HIF1AROCK1DHFR
SCHEMBL6713307 0.87 HIF1A (0.41) HIF1A
SCHEMBL6708765 0.85 HIF1A (0.43) HIF1AROCK1ITKACLY
SCHEMBL6709849 0.85 GPR27 (0.41) HIF1AROCK1

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 296/4885ROCK1 4830/4885ITK 1711/4885

“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.