SCHEMBL1243675

SCHEMBL1243675

CC(C)(NC(=O)O)c1ccc(C(=O)Nc2ccc(Nc3cc(-c4cccc5c4oc4ccccc45)ncn3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIP4K2C Q8TBX8 2/20 0.47
PIP4K2A P48426 5/20 0.42
PIP4K2B P78356 5/20 0.42
PIKFYVE Q9Y2I7 1/20 0.42
CYP1A2 P05177 3/20 0.40
TSHR P16473 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
MAPK1 P28482 2/20 0.40
CYP2C19 P33261 2/20 0.40
CLK4 Q9HAZ1 2/20 0.40
ALDH1A1 P00352 2/20 0.40
EGFR P00533 2/20 0.40
ERBB3 P21860 2/20 0.40
CDK9 P50750 3/20 0.39
HPGD P15428 3/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
USP2 O75604 1/20 0.39

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
SCHEMBL1244613 0.91 PIP4K2C (0.51) PIP4K2CPIP4K2APIP4K2BPIKFYVETSHR
SCHEMBL4378414 0.91 PIP4K2C (0.45) PIP4K2CPIP4K2APIP4K2BPIKFYVECYP1A2
SCHEMBL1243665 0.89 PIP4K2C (0.49) PIP4K2CPIP4K2APIP4K2BPIKFYVETSHR
SCHEMBL1243893 0.89 PIP4K2C (0.51) PIP4K2CPIP4K2APIP4K2BPIKFYVECYP1A2
Benzamide SCHEMBL28526510 0.87 PIP4K2C (0.46) PIP4K2CPIP4K2APIP4K2BPIKFYVEMAPK1
Trifluoroacetic Acid SCHEMBL1243874 0.87 PIP4K2C (0.46) PIP4K2CPIP4K2APIP4K2BPIKFYVEEGFR
SCHEMBL4378412 0.87 PIP4K2C (0.46) PIP4K2CPIP4K2APIP4K2BPIKFYVECYP1A2
SCHEMBL16415895 0.86 PIP4K2C (0.46) PIP4K2CPIP4K2APIP4K2BPIKFYVEEGFR
SCHEMBL1244782 0.86 PIP4K2C (0.57) PIP4K2CPIP4K2APIP4K2BPIKFYVECYP1A2
SCHEMBL28616749 0.86 PIP4K2C (0.50) PIP4K2CPIP4K2APIP4K2BPIKFYVETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7879853-B2 tyrosisne kinase inhibitors such as N-[4-(6-Dibenzofuran-4-yl-pyrimidin-4-ylamino)-phenyl]-4-morpholin-4-yl-benzamide, used as anticasrcinogenic or antoproliferative agents, especially in the treatment of breast cancer BAYER SCHERING PHARMA AG (DE) 2011-02-01 US claimed
EP-1763526-B1 4,6-DISUBSTITUTED PYRIMIDINES AND THEIR USE AS PROTEIN KINASE INHIBITORS BAYER SCHERING PHARMA AG (DE) 2009-06-24 EP claimed
US-7879853-B2 tyrosisne kinase inhibitors such as N-[4-(6-Dibenzofuran-4-yl-pyrimidin-4-ylamino)-phenyl]-4-morpholin-4-yl-benzamide, used as anticasrcinogenic or antoproliferative agents, especially in the treatment of breast cancer BAYER SCHERING PHARMA AG (DE) 2011-02-01 US disclosed
EP-1763526-B1 4,6-DISUBSTITUTED PYRIMIDINES AND THEIR USE AS PROTEIN KINASE INHIBITORS BAYER SCHERING PHARMA AG (DE) 2009-06-24 EP disclosed
US-20070208034-A1 4,6-disubstituted pyrimidines and their use as protein kinase inhibitors ATLANTA PHARMA AG (DE) 2007-09-06 US disclosed
EP-1763526-A1 4,6-DISUBSTITUTED PYRIMIDINES AND THEIR USE AS PROTEIN KINASE INHIBITORS Altana Pharma AG (DE) 2007-03-21 EP disclosed
WO-2006000589-A1 4,6-DISUBSTITUTED PYRIMIDINES AND THEIR USE AS PROTEIN KINASE INHIBITORS ALTANA PHARMA AG (DE) 2006-01-05 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-20070208034-A1 4,6-disubstituted pyrimidines and their use as protein kinase inhibitors CDK2, DCK, DTYMK PIP4K2C 52/4885PIP4K2A 59/4885PIP4K2B 22/4885

“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.