SCHEMBL481083

SCHEMBL481083

CC(=O)c1ccc(OCc2nc(Cc3ccc(I)cc3)no2)c(C)c1O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GSTP1 P09211 8/20 0.46
TSHR P16473 2/20 0.44
MAPK1 P28482 1/20 0.41
GRM2 Q14416 2/20 0.39
CYSLTR1 Q9Y271 2/20 0.39

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
SCHEMBL481437 0.89 MAPT (0.48) MAPTTDP1CYP2C9CYP2C19SMN1; SMN2
SCHEMBL481213 0.89 MAPT (0.52) MAPTTDP1CYP2C9CYP2C19SMN1; SMN2
SCHEMBL481352 0.89 TDP1 (0.52) MAPTTDP1CYP2C9CYP2C19SMN1; SMN2
SCHEMBL27816774 0.83 MAPT (0.42) MAPTTDP1GSTP1TSHRMAPK1
SCHEMBL5383808 0.82 TSHR (0.43) MAPTTDP1SMN1; SMN2GSTP1TSHR
SCHEMBL481378 0.82 TDP1 (0.53) MAPTTDP1CYP2C9CYP2C19SMN1; SMN2
SCHEMBL480977 0.78 MAPT (0.48) MAPTTDP1CYP2C9CYP2C19SMN1; SMN2
SCHEMBL481186 0.78 MAPT (0.43) MAPTTDP1CYP2C9CYP2C19SMN1; SMN2
SCHEMBL27816777 0.75 TSHR (0.46) MAPTTDP1GSTP1TSHRMAPK1
SCHEMBL8263497 0.74 MAPT (0.53) MAPTTDP1CYP2C9CYP2C19SMN1; SMN2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2441762-A1 Potentiators of Glutamate Receptors Eli Lilly and Company (US) 2012-04-18 EP disclosed
EP-1817301-B1 POTENTIATORS OF GLUTAMATE RECEPTORS LILLY CO ELI (US) 2012-02-01 EP disclosed
US-7816523-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2010-10-19 US disclosed
US-7803938-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2010-09-28 US disclosed
US-20090318481-A1 Potentiators Of Glutamate Receptors AICHER THOMAS DANIEL 2009-12-24 US disclosed
US-20090318483-A1 Potentiators Of Glutamate Receptors AICHER THOMAS DANIEL 2009-12-24 US disclosed
US-7598423-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2009-10-06 US disclosed
US-20080139505-A1 Potentiators Of Glutamate Receptors ARRAY BIOPHARMA, INC. 2008-06-12 US disclosed
EP-1817301-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2007-08-15 EP disclosed
WO-2006057870-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2006-06-01 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 (3 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-20080139505-A1 Potentiators Of Glutamate Receptors GRM1, GRIN1, GRM2 MAPT 3525/4885TDP1 4070/4885CYP2C9 890/4885
US-20090318481-A1 Potentiators Of Glutamate Receptors GRIK1, GRIK2, GRIK4 MAPT 2945/4885TDP1 3666/4885CYP2C9 1387/4885
US-20090318483-A1 Potentiators Of Glutamate Receptors GRIK1, GRIK2, GRIK4 MAPT 2945/4885TDP1 3666/4885CYP2C9 1387/4885

“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.