SCHEMBL8282914

SCHEMBL8282914

N#Cc1ccccc1-c1ccc(-c2c(C#N)csc2C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 5/20 0.51
GRIA2 P42262 4/20 0.51
ESR2 Q92731 1/20 0.50
PTPN5 P54829 1/20 0.44
FFAR1 O14842 1/20 0.42
AKR1B1 P15121 1/20 0.42
EIF4E P06730 1/20 0.41
MME P08473 1/20 0.40
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
EGLN1 Q9GZT9 1/20 0.38
CTSA P10619 1/20 0.37
XDH P47989 1/20 0.37
DAO P14920 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL8282816 0.85 GRIA4 (0.53) GRIA4GRIA2ESR2EIF4EFNTA
SCHEMBL3128599 0.81 GRIA2 (0.47) GRIA4GRIA2ESR2FFAR1AKR1B1
SCHEMBL2039846 0.76 ESR2 (0.62) GRIA4GRIA2ESR2PTPN5FFAR1
SCHEMBL8282828 0.75 GRIA2 (0.46) GRIA4GRIA2ALDH1A1
SCHEMBL3136013 0.75 GRIA4 (0.77) GRIA4GRIA2FNTAFNTB
SCHEMBL3138584 0.75 GRIA4 (0.65) GRIA4GRIA2ESR2PTPN5FNTA
SCHEMBL3138108 0.74 GRIA4 (0.66) GRIA4GRIA2ESR2FNTAFNTB
SCHEMBL5728657 0.73 GRIA4 (0.67) GRIA4GRIA2ESR2FNTAFNTB
SCHEMBL27969495 0.72 ALAD (0.46) GRIA4GRIA2ESR2PTPN5FFAR1
Benzoic Acid SCHEMBL8919114 0.72 ESR2 (0.58) GRIA4GRIA2ESR2PTPN5FFAR1

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-7642361-B2 Thiophene and furan compounds ELI LILLY AND COMPANY (US) 2010-01-05 US disclosed
US-20070105852-A1 Thiophene and furan compounds ELI LILLY AND COMPANY 2007-05-10 US disclosed
WO-2005070916-A1 THIOPHENE AND FURAN COMPOUNDS ELI LILLY AND COMPANY (US) 2005-08-04 WO disclosed

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-20070105852-A1 Thiophene and furan compounds PSEN2, PSEN1, TPMT GRIA4 15/4885GRIA2 57/4885ESR2 1593/4885

“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.