SCHEMBL3563686

SCHEMBL3563686

CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1NC(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
CPB1 P15086 2/20 0.54
ALDH1A1 P00352 2/20 0.52
GAA P10253 1/20 0.52
SYK P43405 1/20 0.51
CTSB P07858 2/20 0.51
CTSS P25774 2/20 0.51
CTSK P43235 2/20 0.51
CASP3 P42574 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TSHR P16473 1/20 0.50
EPHX1 P07099 1/20 0.50
PDE4B Q07343 1/20 0.49
CTSL P07711 1/20 0.48

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
SCHEMBL4033681 0.97 CPB1 (0.54) KMT2AL3MBTL1CPB1ALDH1A1GAA
SCHEMBL30441712 0.94 KMT2A (0.53) KMT2AL3MBTL1CPB1ALDH1A1GAA
SCHEMBL24515752 0.88 CPB1 (0.56) KMT2AL3MBTL1CPB1ALDH1A1GAA
SCHEMBL24515749 0.88 CPB1 (0.56) KMT2AL3MBTL1CPB1ALDH1A1GAA
SCHEMBL12667212 0.88 KMT2A (0.63) KMT2AL3MBTL1CPB1ALDH1A1GAA
SCHEMBL6370475 0.88 KMT2A (0.63) KMT2AL3MBTL1CPB1ALDH1A1GAA
SCHEMBL16523966 0.88 KMT2A (0.63) KMT2AL3MBTL1CPB1ALDH1A1GAA
SCHEMBL1864036 0.88 KMT2A (0.63) KMT2AL3MBTL1CPB1ALDH1A1GAA
SCHEMBL2670623 0.88 KMT2A (0.63) KMT2AL3MBTL1CPB1ALDH1A1GAA
SCHEMBL3888143 0.87 ALDH1A1 (0.61) KMT2AL3MBTL1CPB1ALDH1A1GAA

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-7820648-B2 Pyrimidine derivatives for the treatment of abnormal cell growth PFIZER INC (US) 2010-10-26 US disclosed
US-20080234303-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER INC 2008-09-25 US disclosed
EP-1966207-A2 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH Pfizer Products Inc. (US) 2008-09-10 EP disclosed
WO-2007072158-A2 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PRODUCTS INC. (US) 2007-06-28 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 (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-20080234303-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH CCNB1, TYMS, CCNA1 KMT2A 1056/4885L3MBTL1 704/4885CPB1 3358/4885

“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.