SCHEMBL6738604

SCHEMBL6738604

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

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 6/20 0.58
LMNA P02545 3/20 0.51
NAMPT P43490 1/20 0.48
GAA P10253 2/20 0.48
TSHR P16473 1/20 0.48
PSMB5 P28074 2/20 0.48
RNF4 P78317 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP3A4 P08684 1/20 0.45
LTB4R2 Q9NPC1 1/20 0.44
MMP13 P45452 1/20 0.43

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
SCHEMBL6733814 0.87 GRM2 (0.62) GRM2LMNANAMPTGAATSHR
SCHEMBL6739479 0.87 NPY5R (0.51) GRM2LMNAPSMB5RNF4ALDH1A1
SCHEMBL6732704 0.85 GRM2 (0.63) GRM2LMNANAMPTGAATSHR
SCHEMBL6735689 0.85 GRM2 (0.60) GRM2LMNANAMPTGAATSHR
SCHEMBL6731406 0.81 GRM2 (0.55) GRM2NAMPTGAATSHRCYP3A4
SCHEMBL6733035 0.79 MAPT (0.54) GRM2LMNANAMPTGAATSHR
SCHEMBL6736102 0.79 MLYCD (0.49) GAATSHRRNF4ALDH1A1LTB4R2
SCHEMBL6731950 0.77 GRM2 (0.75) GRM2
SCHEMBL6739041 0.76 CYP3A4 (0.50) GRM2NAMPTGAATSHRCYP3A4
SCHEMBL22289326 0.75 GAA (0.73) GRM2LMNAGAATSHRALDH1A1

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 3 patents. 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
EP-1255735-A2 PYRIDINE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2002-11-13 EP claimed
WO-2001056990-A2 PYRIDINE DERIVATES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2001-08-09 WO 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 3/4885LMNA 4863/4885NAMPT 3202/4885

“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.