SCHEMBL6714243

SCHEMBL6714243

COc1ccc(-c2ccc3cc(C(=O)Nc4ccc(Br)cc4-c4noc(=O)[nH]4)n(C)c3c2)c(OC)c1OC

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LCK P06239 12/20 0.37
HCK P08631 7/20 0.36
MAPT P10636 1/20 0.35
GRIK1 P39086 1/20 0.35
IMPDH2 P12268 1/20 0.35
ROCK1 Q13464 1/20 0.34
GPR35 Q9HC97 1/20 0.34
POLB P06746 2/20 0.34
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FYN P06241 1/20 0.33
LYN P07948 1/20 0.33
FGR P09769 1/20 0.33
SRC P12931 1/20 0.33
TEK Q02763 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
SCHEMBL6713698 0.91 CPT1A (0.40) LCKHCKMAPTGRIK1IMPDH2
SCHEMBL6709959 0.89 LCK (0.38) LCKHCKMAPTIMPDH2ROCK1
SCHEMBL6709833 0.85 MAPT (0.42) MAPTGRIK1GPR35POLBMEN1
SCHEMBL6711717 0.85 GPR35 (0.38) LCKHCKMAPTIMPDH2GPR35
SCHEMBL6708878 0.84 ROCK1 (0.40) LCKMAPTGRIK1ROCK1GPR35
SCHEMBL6710340 0.83 ROCK1 (0.39) LCKGRIK1ROCK1LMNANPSR1
SCHEMBL6710487 0.82 FTO (0.42) GRIK1ROCK1LMNAKMT2A
SCHEMBL6710341 0.81 ROCK1 (0.38) LCKMAPTGRIK1ROCK1NPSR1
SCHEMBL6708958 0.81 MAPT (0.46) MAPTGRIK1MEN1KMT2A
SCHEMBL6710127 0.81 ROCK1 (0.47) LCKGRIK1IMPDH2ROCK1LMNA

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 LCK 4247/4885HCK 3809/4885MAPT 4754/4885

“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.