SCHEMBL8364837

SCHEMBL8364837

Nc1cnc(O)c(C=O)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 14/20 0.34
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
DDO Q99489 1/20 0.31
TRIM24 O15164 1/20 0.31
TRIM33 Q9UPN9 1/20 0.31

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
SCHEMBL22105601 0.75 ERN1 (0.48) ERN1
SCHEMBL29955769 0.75 CYP1A2 (0.38) ERN1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL29956734 0.75 ERN1 (0.54) ERN1KDM4EMEN1ALDH1A1LMNA
SCHEMBL29950916 0.75 ERN1 (0.54) ERN1
SCHEMBL1619507 0.75 ERN1 (0.54) ERN1
SCHEMBL31265477 0.75 ERN1 (0.48) ERN1ALDH1A1LMNAKMT2ATRIM24
SCHEMBL29956834 0.75 ERN1 (0.48) ERN1
SCHEMBL14115886 0.75 ERN1 (0.48) ERN1ALDH1A1LMNAKMT2ATRIM24
SCHEMBL21232612 0.72 ESR2 (0.42) ERN1KDM4EKMT2A
SCHEMBL29956411 0.71 ALOX5AP (0.34) ERN1

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-7928233-B2 Spiroindolinone pyridine derivatives HOFFMANN-LA ROCHE INC. (US) 2011-04-19 US disclosed
US-20100204257-A1 SPIROINDOLINONE PYRIDINE DERIVATIVES CHEN LI 2010-08-12 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-20100204257-A1 SPIROINDOLINONE PYRIDINE DERIVATIVES RB1, KRAS, WEE1 ERN1 1347/4885KDM4E 1739/4885MEN1 904/4885

“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.