SCHEMBL6709918

SCHEMBL6709918

COCCOc1cccc2cc(C(=O)Nc3ccc(Br)cc3-c3noc(=O)[nH]3)n(C)c12

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.38
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
BRPF1 P55201 1/20 0.34
BACE1 P56817 5/20 0.34
AKT1 P31749 2/20 0.34
GRM5 P41594 1/20 0.34
MALT1 Q9UDY8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HIF1A Q16665 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
LCK P06239 1/20 0.32
PDE5A O76074 1/20 0.32
GPR35 Q9HC97 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
SCHEMBL6712425 0.93 TP53 (0.38) GRIK1LMNAMAPTGRM5PDE5A
SCHEMBL6710044 0.92 GRIK1 (0.36) GRIK1LMNAMAPTBACE1GRM5
SCHEMBL6710289 0.91 GRIK1 (0.36) GRIK1LMNAMAPTBACE1GRM5
SCHEMBL6711990 0.91 GRIK1 (0.40) GRIK1LMNAMAPTBRPF1AKT1
SCHEMBL6709898 0.89 GRIK1 (0.36) GRIK1LMNAMAPTBRPF1BACE1
SCHEMBL6708956 0.89 LRRK2 (0.38) GRIK1LMNAMAPTBACE1
SCHEMBL6713672 0.89 GRIK1 (0.36) GRIK1LMNAMAPTBACE1GRM5
SCHEMBL6708800 0.89 KDM1A (0.34) LMNAMAPTBRPF1AKT1RXFP1
SCHEMBL6711788 0.89 KDM1A (0.36) GRIK1LMNAMAPTBACE1GRM5
SCHEMBL6710035 0.88 GRIK1 (0.36) GRIK1LMNAMAPTBACE1GRM5

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 3885/4885LMNA 4062/4885MAPT 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.