SCHEMBL6103804

SCHEMBL6103804

CN(C)C=CC(=O)c1cncn1C

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.47
RECQL P46063 2/20 0.42
MAPT P10636 8/20 0.40
RAB9A P51151 5/20 0.40
LMNA P02545 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
HPGD P15428 2/20 0.40
ALOX12 P18054 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
ALDH1A1 P00352 7/20 0.39
POLB P06746 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 3/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
KDM4E B2RXH2 2/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL6103800 1.00 HTT (0.47) HTTRECQLMAPTRAB9ALMNA
SCHEMBL4867493 0.80 HTT (0.44) HTTRECQLMAPTRAB9ALMNA
SCHEMBL4867499 0.80 HTT (0.44) HTTRECQLMAPTRAB9ALMNA
SCHEMBL15594049 0.75 RBP4 (0.34) TDP1ALDH1A1KMT2AMEN1
SCHEMBL211015 0.73 HTT (0.44) HTTRECQLMAPTRAB9ALMNA
SCHEMBL211016 0.73 HTT (0.44) HTTRECQLMAPTRAB9ALMNA
SCHEMBL9788731 0.73 RBP4 (0.35) HTTCYP1A2CYP2C19HPGDTDP1
SCHEMBL13879038 0.72 PTGS2 (0.39) HTTRECQLMAPTRAB9ALMNA
SCHEMBL4247027 0.72 PTGS2 (0.39) HTTRECQLMAPTRAB9ALMNA
SCHEMBL5098850 0.72 HTT (0.42) HTTRECQLMAPTRAB9ALMNA

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-20060004033-A1 Imidazolo-5-yl-2-anilino-pyrimidines as agents for the inhibition of the cell proliferation ASTRAZENECA AB 2006-01-05 US disclosed
US-6969714-B2 Imidazolo-5-YL-2-anilino-pyrimidines as agents for the inhibition of the cell proliferation ASTRAZENECA AB (SE) 2005-11-29 US disclosed
EP-1351958-B1 IMIDAZOLO-5-YL-2-ANILINO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF THE CELL PROLIFERATION ASTRAZENECA AB (SE) 2004-06-16 EP disclosed
US-20040014776-A1 Imidazolo-5-YL-2anilino-pyrimidines as agents for the inhibition of the cell proliffration ASTRAZENECA AB (SE) 2004-01-22 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 (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-20060004033-A1 Imidazolo-5-yl-2-anilino-pyrimidines as agents for the inhibition of the cell proliferation MKI67, CCNI, CCNT1 HTT 4348/4885RECQL 35/4885MAPT 4607/4885
US-20040014776-A1 Imidazolo-5-YL-2anilino-pyrimidines as agents for the inhibition of the cell proliffration CCNI, TYMP, MKI67 HTT 4573/4885RECQL 61/4885MAPT 4470/4885

“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.