SCHEMBL6709189

SCHEMBL6709189

CCCCCOc1cccc2cc(C(=O)Nc3ccc(Cl)cc3-c3noc(=O)[nH]3)n(C)c12

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.39
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
CMKLR1 Q99788 1/20 0.37
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
GRM5 P41594 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
CNR2 P34972 4/20 0.35
PTPN1 P18031 1/20 0.35
GRM4 Q14833 1/20 0.34
NR3C1 P04150 1/20 0.34
CNR1 P21554 1/20 0.34
POLB P06746 1/20 0.34
PTGER1 P34995 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
SCHEMBL6711990 0.93 GRIK1 (0.40) GRIK1LMNAMAPTGRM5RXFP1
SCHEMBL6710184 0.92 GRIK1 (0.38) GRIK1CMKLR1LMNAMAPTGRM5
SCHEMBL6708695 0.91 GRIK1 (0.38) GRIK1TP53CMKLR1LMNAMAPT
SCHEMBL6712425 0.91 TP53 (0.38) GRIK1TP53TSHRLMNAMAPT
SCHEMBL6710160 0.89 TP53 (0.36) TP53TSHRLMNAMAPTRXFP1
SCHEMBL6713393 0.89 GRIK1 (0.39) GRIK1TSHRMAPTPTGER1
SCHEMBL6710303 0.88 ALDH1A1 (0.38) GRIK1TP53TSHRLMNAMAPT
SCHEMBL6713869 0.88 GRIK1 (0.38) GRIK1CMKLR1PTGER1
SCHEMBL6708708 0.87 IRAK4 (0.38) GRIK1CMKLR1LMNAMAPTGRM5
SCHEMBL6708711 0.87 IRAK4 (0.38) GRIK1CMKLR1LMNAMAPTGRM5

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 3885/4885TP53 2699/4885TSHR 3901/4885

“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.