SCHEMBL4281260

SCHEMBL4281260

CC(C)N(CCON1C(=O)c2ccccc2C1=O)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
ALDH1A1 P00352 4/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 1/20 0.41
RECQL P46063 1/20 0.40
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
PTPRC P08575 2/20 0.36
MALT1 Q9UDY8 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL16577975 0.89 GAA (0.40) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL20902084 0.89 GAA (0.40) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL20902091 0.89 GAA (0.40) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL14233174 0.89 GAA (0.40) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL20902098 0.89 GAA (0.40) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL23790829 0.86 GAA (0.38) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL4267818 0.85 GAA (0.48) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL21871392 0.82 MAOB (0.44) ALDH1A1SMN1; SMN2TDP1
SCHEMBL14238192 0.81 GAA (0.43) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL14234032 0.81 GAA (0.43) GAAALDH1A1CYP1A2CYP2C9RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7608627-B2 I kappa B kinase inhibition; diabetes; (7-Chloro-1H-pyrrolo[2,3-c]pyridin-2-yl)methanol; N-Benzyl-7-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-27 US disclosed
US-20080064715-A1 6-Azaindole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-03-13 US 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-20080064715-A1 6-Azaindole Compound RELA, NFKBIA, GPR119 GAA 4189/4885ALDH1A1 3508/4885CYP1A2 3216/4885

“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.