SCHEMBL6738644

SCHEMBL6738644

CCS(=O)(=O)N(Cc1ccccn1)c1ccc(Oc2ccc(C#N)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 4/20 0.51
NR3C1 P04150 3/20 0.51
PGR P06401 1/20 0.51
SCN9A Q15858 1/20 0.45
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
BRD4 O60885 1/20 0.40
CXCR3 P49682 2/20 0.40
POLB P06746 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.39
SLC6A4 P31645 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
ALDH1A1 P00352 1/20 0.39
FFAR1 O14842 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
SCHEMBL6739470 0.88 GRM2 (0.63) GRM2NR3C1PGRMMP2MMP9
SCHEMBL6732075 0.87 NR3C1 (0.47) GRM2NR3C1PGRSCN9AMMP2
SCHEMBL6730834 0.85 GRM2 (0.54) GRM2NR3C1PGRMMP2MMP9
SCHEMBL6732109 0.84 GRM2 (0.62) GRM2NR3C1PGRALDH1A1
SCHEMBL6727564 0.83 GRM2 (0.60) GRM2NR3C1PGRMMP2MMP9
SCHEMBL6736493 0.83 GRM2 (0.57) GRM2NR3C1PGRMMP2MMP9
SCHEMBL6732783 0.82 OXTR (0.51) GRM2NR3C1PGRALDH1A1
SCHEMBL6733380 0.81 HPGD (0.48) GRM2BRD4TRPM8ALDH1A1
SCHEMBL6739544 0.81 NR3C1 (0.53) GRM2NR3C1MMP2MMP9POLB
SCHEMBL6735511 0.81 HTT (0.56) GRM2BRD4ALDH1A1

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 4 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
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 3/4885NR3C1 336/4885PGR 697/4885

“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.