SCHEMBL6731406

SCHEMBL6731406

O=C(C1CC1)N(Cc1cccnc1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.55
CYP3A4 P08684 3/20 0.52
MAPT P10636 6/20 0.48
TP53 P04637 5/20 0.48
NAMPT P43490 1/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.46
DHODH Q02127 1/20 0.45

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
SCHEMBL6733035 0.96 MAPT (0.54) GRM2CYP3A4MAPTTP53NAMPT
SCHEMBL6739041 0.95 CYP3A4 (0.50) GRM2CYP3A4MAPTTP53NAMPT
SCHEMBL6735083 0.93 GRM2 (0.50) GRM2CYP3A4MAPTTP53
SCHEMBL6730973 0.92 MAPT (0.51) GRM2CYP3A4MAPTTP53
SCHEMBL7419432 0.91 CYP3A4 (0.49) GRM2CYP3A4MAPTTP53GAA
SCHEMBL6730763 0.90 CYP3A4 (0.59) GRM2CYP3A4MAPTTP53GAA
SCHEMBL6727717 0.88 CYP19A1 (0.48) GRM2CYP3A4MAPTTP53
SCHEMBL6739403 0.87 MAPT (0.51) CYP3A4MAPTTP53
SCHEMBL6739591 0.87 CYP3A4 (0.46) GRM2CYP3A4MAPTTP53NAMPT
SCHEMBL6732626 0.87 GRM2 (0.55) GRM2CYP3A4MAPTTP53GAA

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-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 3/4885CYP3A4 2786/4885MAPT 3885/4885

“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.