SCHEMBL1244342

SCHEMBL1244342

O=C(O)Nc1cccc(Nc2cc(-c3cccc4c3oc3ccccc34)ncn2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.47
CYP2D6 P10635 3/20 0.47
TSHR P16473 3/20 0.47
CYP3A4 P08684 2/20 0.47
MAPK1 P28482 2/20 0.47
CYP2C19 P33261 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47
PIP4K2C Q8TBX8 2/20 0.46
CCNT1 O60563 6/20 0.43
CDK9 P50750 6/20 0.43
MAPT P10636 4/20 0.43
TP53 P04637 2/20 0.43
LMNA P02545 2/20 0.42
THRB P10828 1/20 0.42
MAP4K4 O95819 1/20 0.42
CDK1 P06493 1/20 0.42
CDK4 P11802 1/20 0.42
CCNB1 P14635 1/20 0.42
CCND1 P24385 1/20 0.42

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
SCHEMBL1243786 0.94 PIP4K2C (0.49) CYP1A2CYP2D6TSHRCYP3A4MAPK1
SCHEMBL1244720 0.93 ALDH1A1 (0.48) CYP1A2CYP2D6TSHRCYP3A4MAPK1
SCHEMBL1244782 0.93 PIP4K2C (0.57) CYP1A2CYP2D6TSHRCYP3A4MAPK1
SCHEMBL1244414 0.90 PIP4K2C (0.46) CYP1A2CYP2D6TSHRCYP3A4MAPK1
SCHEMBL1244513 0.89 PIP4K2C (0.49) CYP1A2CYP2D6TSHRCYP3A4MAPK1
SCHEMBL1244379 0.86 PIP4K2C (0.50) CYP1A2CYP2D6TSHRCYP3A4MAPK1
SCHEMBL1244549 0.86 PIP4K2C (0.46) CYP1A2CYP2D6TSHRCYP3A4MAPK1
SCHEMBL1244611 0.86 PIP4K2C (0.53) ALDH1A1PIP4K2CCCNT1CDK9MAPT
SCHEMBL1244287 0.85 PIP4K2C (0.46) CYP1A2CYP2D6TSHRCYP3A4MAPK1
SCHEMBL1241945 0.85 CYP3A4 (0.41) CYP1A2CYP2D6TSHRCYP3A4MAPK1

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 5 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 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 CYP1A2 2241/4885CYP2D6 1190/4885TSHR 4039/4885

“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.