SCHEMBL4522936

SCHEMBL4522936

CC(C)(C)OC(=O)NC1(C(=O)O)CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.39
EPHX2 P34913 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
EPHX1 P07099 1/20 0.37
MAPT P10636 2/20 0.37
USP30 Q70CQ3 2/20 0.35
MMP2 P08253 1/20 0.35
MMP13 P45452 1/20 0.35
MMP14 P50281 1/20 0.35
ADAM17 P78536 1/20 0.35
CYP1A2 P05177 1/20 0.34
SCD5 Q86SK9 1/20 0.34
HDAC2 Q92769 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34

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
SCHEMBL21777669 0.92 EPHX2 (0.40) EPHX2USP2SMN1; SMN2EPHX1USP30
SCHEMBL30713621 0.86 EPHX2 (0.40) HPGDEPHX2MEN1KMT2AUSP2
SCHEMBL21045024 0.84 HPGD (0.35) HPGDEPHX2MEN1KMT2AUSP2
SCHEMBL19859634 0.84 HPGD (0.35) HPGDEPHX2MEN1KMT2AUSP2
SCHEMBL391708 0.83 USP2 (0.45) HPGDEPHX2MEN1KMT2AUSP2
SCHEMBL76966 0.82 BTK (0.38) MEN1KMT2AEPHX1ALDH1A1
SCHEMBL29080198 0.82 CTSL (0.46) MEN1KMT2ASMN1; SMN2
SCHEMBL4569995 0.82 CTSS (0.51) MEN1KMT2AUSP30
SCHEMBL28189059 0.82 CYP4F2 (0.33) EPHX2MEN1KMT2AUSP2SMN1; SMN2
SCHEMBL1012064 0.81 FAAH (0.39) MEN1KMT2AEPHX1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270390-A1 PYRIMIDINE DERIVATIVES ASTRAZENECA (SE) 2009-10-29 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-20090270390-A1 PYRIMIDINE DERIVATIVES TYMP, DPYD, TYMS HPGD 636/4885EPHX2 1800/4885MEN1 2960/4885

“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.