SCHEMBL5314487

SCHEMBL5314487

C[C@H](Nc1nccc(Nc2nc(-c3ccccc3)cc3ncnn23)n1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 2/20 0.46
HTR7 P34969 4/20 0.46
CAMK2D Q13557 7/20 0.43
LCK P06239 4/20 0.43
ABL1 P00519 1/20 0.43
CSF1R P07333 1/20 0.43
PDGFRB P09619 1/20 0.43
MAP2K2 P36507 1/20 0.43
CDK7 P50613 1/20 0.43
ADRA1D P25100 1/20 0.41
HTR2C P28335 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
MAPK13 O15264 2/20 0.41
MAPK12 P53778 2/20 0.41
MAPK11 Q15759 2/20 0.41
MAPK14 Q16539 2/20 0.41
MAPKAPK2 P49137 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
SCHEMBL6414904 1.00 PLK1 (0.46) PLK1HTR7CAMK2DLCKABL1
SCHEMBL6414447 0.83 ALDH1A1 (0.36) PLK1CAMK2D
SCHEMBL6415712 0.82 MEN1 (0.39) PLK1LCK
SCHEMBL5318263 0.78 MAPT (0.41) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6414897 0.78 HTR7 (0.46) HTR7HTR2C
SCHEMBL5311751 0.76 ALDH1A1 (0.39)
SCHEMBL5317535 0.76 BPTF (0.46)
SCHEMBL13220952 0.71 GSK3B (0.53)
SCHEMBL13708543 0.67 MAPK14 (0.39) CAMK2DMAPK13MAPK12MAPK11MAPK14
SCHEMBL4084334 0.67 MAPK14 (0.39) CAMK2DMAPK13MAPK12MAPK11MAPK14

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-20050288502-A1 Substituted heterocyclic compounds and methods of use AMGEN, INC. 2005-12-29 US claimed
EP-1765825-A1 CONDENSED TRIAZOLES AND INDAZOLES USEFUL IN TREATING CITOKINES MEDIATED DISEASES AND OTHER DISEASES AMGEN INC. (US) 2007-03-28 EP disclosed
WO-2006004702-A1 CONDENSED TRIAZOLES AND INDAZOLES USEFUL IN TREATING CITOKINES MEDIATED DISEASES AND OTHER DISEASES AMGEN INC. (US) 2006-01-12 WO disclosed
US-20050288502-A1 Substituted heterocyclic compounds and methods of use AMGEN, INC. 2005-12-29 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-20050288502-A1 Substituted heterocyclic compounds and methods of use MYLK2, IAPP, MAPT PLK1 476/4885HTR7 3740/4885CAMK2D 1065/4885

“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.