SCHEMBL6728181

SCHEMBL6728181

CCS(=O)(=O)N(Cc1ccncc1)c1ccc(Oc2c(OC)cccc2OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 12/20 0.55
PGR P06401 2/20 0.44
NR3C1 P04150 4/20 0.44
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP11B1 P15538 1/20 0.38

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
SCHEMBL6733827 0.93 GRM2 (0.50) GRM2PGRNR3C1CNR1CNR2
SCHEMBL6727498 0.90 GRM2 (0.62) GRM2PGRNR3C1CNR1CNR2
SCHEMBL6734087 0.88 GRM2 (0.67) GRM2PGRNR3C1
SCHEMBL6732511 0.88 GRM2 (0.72) GRM2
SCHEMBL6735185 0.85 GRM2 (0.56) GRM2PGRNR3C1
SCHEMBL6734022 0.83 GRM2 (0.76) GRM2PGRNR3C1
SCHEMBL6733534 0.83 GRM2 (0.62) GRM2PGR
SCHEMBL6730872 0.82 GRM2 (0.47) GRM2LMNA
SCHEMBL6727795 0.81 GRM2 (0.66) GRM2
SCHEMBL6738944 0.80 GRM2 (0.55) GRM2PGRNR3C1CNR2ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6800651-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY 2004-10-05 US claimed
US-20040006114-A1 Potentiators of glutamate receptors ELI LILLY AND COMPANY 2004-01-08 US claimed

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-20040006114-A1 Potentiators of glutamate receptors GRM1, GRIN1, GRM2 GRM2 3/4885PGR 697/4885NR3C1 336/4885

“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.