SCHEMBL5481318

SCHEMBL5481318

CN(C)C=CC(=O)c1cccc(Cn2cncn2)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.60
HDAC6 Q9UBN7 2/20 0.60
MAPT P10636 6/20 0.49
HTT P42858 5/20 0.49
ALDH1A1 P00352 5/20 0.49
GAA P10253 2/20 0.49
HPGD P15428 1/20 0.49
CYP19A1 P11511 5/20 0.48
RECQL P46063 1/20 0.46
RAB9A P51151 3/20 0.45
STS P08842 1/20 0.41
NPC1 O15118 2/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL5479754 0.80 HDAC1 (0.71) HDAC1HDAC6HTTCYP19A1STS
SCHEMBL5480131 0.79 CYP19A1 (0.61) MAPTHTTALDH1A1GAAHPGD
SCHEMBL3639750 0.79 HDAC1 (0.73) HDAC1HDAC6HTTALDH1A1CYP19A1
SCHEMBL306427 0.77 HDAC1 (0.70) HDAC1HDAC6HTTCYP19A1STS
SCHEMBL5480229 0.75 BCHE (0.62) MAPTHTTALDH1A1GAAHPGD
SCHEMBL5481317 0.74 HDAC1 (0.51) HDAC1HDAC6CYP19A1STSKMT2A
SCHEMBL5477573 0.74 MAPT (0.61) MAPTHTTALDH1A1GAAHPGD
SCHEMBL12977861 0.73 HDAC1 (0.56) HDAC1HDAC6HTTGAACYP19A1
SCHEMBL305312 0.73 CYP19A1 (0.67) HDAC1HDAC6CYP19A1STS
SCHEMBL5946453 0.73 MAPT (0.77) MAPTHTTALDH1A1GAAHPGD

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 3 patents. 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
EP-1648875-A1 2-AMINOPHENYL-4-PHENYLPYRIMIDINES AS KINASE INHIBITORS Cyclacel Limited (GB) 2006-04-26 EP disclosed
WO-2005012262-A1 2-AMINOPHENYL-4-PHENYLPYRIMIDINES AS KINASE INHIBITORS CYCLACEL LIMITED (GB) 2005-02-10 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-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors GRK3, NCOR1, GRM3 HDAC1 498/4885HDAC6 1059/4885MAPT 4554/4885

“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.