SCHEMBL5480128

SCHEMBL5480128

CN(C)C(=O)C=Cc1cccc(Cn2ccnc2)c1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 5/20 0.74
CYP1A2 P05177 2/20 0.56
USP2 O75604 1/20 0.56
LMNA P02545 1/20 0.56
MEN1 O00255 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C19 P33261 1/20 0.56
KMT2A Q03164 1/20 0.56
CYP11B1 P15538 8/20 0.55
CYP11B2 P19099 8/20 0.55
CYP19A1 P11511 5/20 0.52
ADRA2C P18825 1/20 0.49

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
SCHEMBL28816559 0.83 TBXAS1 (0.78) TBXAS1CYP1A2USP2LMNAMEN1
SCHEMBL11479926 0.82 TBXAS1 (0.71) TBXAS1CYP1A2USP2LMNAMEN1
SCHEMBL11479922 0.82 TBXAS1 (0.71) TBXAS1CYP1A2USP2LMNAMEN1
SCHEMBL5481317 0.79 HDAC1 (0.51) TBXAS1KMT2ACYP19A1ADRA2C
SCHEMBL8404966 0.78 TBXAS1 (0.69) TBXAS1CYP1A2USP2LMNAMEN1
SCHEMBL7299629 0.78 TBXAS1 (0.69) TBXAS1CYP1A2USP2LMNAMEN1
SCHEMBL7299635 0.78 TBXAS1 (0.69) TBXAS1CYP1A2USP2LMNAMEN1
SCHEMBL7385323 0.78 TBXAS1 (0.69) TBXAS1CYP1A2USP2LMNAMEN1
SCHEMBL9401580 0.77 TBXAS1 (0.68) TBXAS1CYP1A2USP2LMNAMEN1
SCHEMBL7291119 0.77 TBXAS1 (0.68) TBXAS1CYP1A2USP2LMNAMEN1

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-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors CYCLACEL LIMITED (GB) 2007-01-25 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-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors GRK3, NCOR1, GRM3 TBXAS1 2364/4885CYP1A2 1250/4885USP2 4245/4885

“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.