SCHEMBL4020969

SCHEMBL4020969

O=C(NC1CN=C(c2ccccc2)NC1=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 10/20 0.58
CTSL P07711 1/20 0.47
EPHX1 P07099 1/20 0.46
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.44

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
SCHEMBL3930648 0.78 NAAA (0.58) NAAACTSLALDH1A1GAATSHR
SCHEMBL765661 0.78 NAAA (0.58) NAAACTSLALDH1A1GAATSHR
SCHEMBL5180974 0.78 NAAA (0.58) NAAACTSLALDH1A1GAATSHR
SCHEMBL5200673 0.76 CRBN (0.60) NAAACTSLALDH1A1GAATSHR
SCHEMBL3544056 0.76 CRBN (0.60) NAAACTSLALDH1A1GAATSHR
SCHEMBL632914 0.76 CRBN (0.60) NAAACTSLALDH1A1GAATSHR
SCHEMBL4079431 0.75 NAAA (0.85) NAAACTSL
SCHEMBL4073930 0.75 NAAA (0.85) NAAACTSL
SCHEMBL4073924 0.75 NAAA (0.85) NAAACTSL
SCHEMBL5105468 0.74 NAAA (0.52) NAAACTSLEPHX1ALDH1A1GAA

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-20090137803-A1 5-PROTECTED AMINOPYRIMIDINE COMPOUND, PRODUCTION METHOD THEREOF AND INTERMEDIATE THEREFOR AJINOMOTO CO., INC. (JP) 2009-05-28 US disclosed
US-7507738-B2 5-protected aminopyrimidine compound, production method thereof and intermediate therefor AJINOMOTO CO., INC. (JP) 2009-03-24 US disclosed
US-20050209257-A1 5-Protected aminopyrimidine compound, production method thereof and intermediate therefor AJINOMOTO CO., INC. (JP) 2005-09-22 US disclosed
EP-1577303-A1 5-protected aminopyrimidine compound, production method thereof and intermediate thereof Ajinomoto Co., Inc. (JP) 2005-09-21 EP 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 (2 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-20050209257-A1 5-Protected aminopyrimidine compound, production method thereof and intermediate therefor DPYD, DHPS, DHFR NAAA 1071/4885CTSL 3214/4885EPHX1 1928/4885
US-20090137803-A1 5-PROTECTED AMINOPYRIMIDINE COMPOUND, PRODUCTION METHOD THEREOF AND INTERMEDIATE THEREFOR DPYD, DHPS, DHFR NAAA 1071/4885CTSL 3214/4885EPHX1 1928/4885

“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.