SCHEMBL6728076

SCHEMBL6728076

O=C(C1CC1)N(Cc1cccnc1)c1ccc(Oc2ccccc2)c(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.49
MAPT P10636 5/20 0.42
TP53 P04637 4/20 0.42
SUCNR1 Q9BXA5 1/20 0.42
GRM2 Q14416 2/20 0.41
POLB P06746 1/20 0.41
PDK1 Q15118 1/20 0.41
UBE2M P61081 1/20 0.41
DCUN1D1 Q96GG9 1/20 0.41
NR1H4 Q96RI1 1/20 0.40

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
SCHEMBL21168598 0.87 CYP3A4 (0.46) CYP3A4MAPTTP53SUCNR1GRM2
SCHEMBL6727825 0.87 CYP3A4 (0.51) CYP3A4MAPTTP53GRM2PDK1
SCHEMBL18763021 0.84 GSTO1 (0.48) MAPTTP53SUCNR1GRM2PDK1
SCHEMBL29883277 0.84 GSTO1 (0.48) MAPTTP53SUCNR1GRM2PDK1
SCHEMBL6731406 0.83 GRM2 (0.55) CYP3A4MAPTTP53GRM2
SCHEMBL6730763 0.83 CYP3A4 (0.59) CYP3A4MAPTTP53GRM2
SCHEMBL6733385 0.81 CYP3A4 (0.47) CYP3A4MAPTTP53GRM2UBE2M
SCHEMBL6731186 0.80 MAPT (0.51) CYP3A4MAPTTP53GRM2POLB
SCHEMBL6733035 0.80 MAPT (0.54) CYP3A4MAPTTP53GRM2POLB
SCHEMBL6736384 0.80 MAPT (0.48) CYP3A4MAPTTP53

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 CYP3A4 2786/4885MAPT 3885/4885TP53 4850/4885

“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.