SCHEMBL4159368

SCHEMBL4159368

Cc1cc(Nc2cncc(Nc3ccc(Cl)c(C(=O)Nc4ccccc4)c3)n2)n[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 4/20 0.48
NTRK1 P04629 4/20 0.48
BDKRB1 P46663 2/20 0.46
AURKA O14965 3/20 0.45
AURKB Q96GD4 3/20 0.45
CSF1R P07333 3/20 0.45
SMO Q99835 1/20 0.44
CCNA2 P20248 1/20 0.44
CDK2 P24941 1/20 0.44
CCNA1 P78396 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
SRC P12931 1/20 0.43
GSK3B P49841 1/20 0.43
AURKC Q9UQB9 1/20 0.43
TYK2 P29597 1/20 0.43
LMNA P02545 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 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
SCHEMBL4176449 0.88 AURKA (0.42) PLK4NTRK1AURKAAURKBMEN1
SCHEMBL4167474 0.88 JAK2 (0.43) AURKAAURKBMEN1KMT2AGSK3B
SCHEMBL4176112 0.87 RET (0.53) PLK4NTRK1AURKAAURKBCSF1R
SCHEMBL4013576 0.85 NPC1 (0.44) PLK4AURKAAURKBCCNA2CDK2
SCHEMBL4161527 0.85 JAK2 (0.44) PLK4NTRK1AURKAAURKB
SCHEMBL4019395 0.84 AURKA (0.51) AURKAAURKBMEN1KMT2ALMNA
SCHEMBL4161296 0.83 JAK2 (0.41) AURKAAURKBMEN1KMT2AHTT
SCHEMBL4019638 0.82 CCNA2 (0.59) AURKAAURKBCSF1RCCNA2CDK2
SCHEMBL4171530 0.82 IGF1R (0.48) AURKAAURKBSRCGSK3BAURKC
SCHEMBL4166885 0.81 MEN1 (0.47) PLK4NTRK1AURKAAURKBCCNA2

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-20090270418-A1 PYRAZOLE PYRAZINE AMINE COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS THEREOF AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2009-10-29 US claimed
WO-2009089042-A1 PYRAZOLE PYRAZINE AMINE COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS THEREOF AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC (US) 2009-07-16 WO claimed
US-20090270418-A1 PYRAZOLE PYRAZINE AMINE COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS THEREOF AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2009-10-29 US disclosed
US-20090270418-A1 PYRAZOLE PYRAZINE AMINE COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS THEREOF AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2009-10-29 US disclosed
US-20090270418-A1 PYRAZOLE PYRAZINE AMINE COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS THEREOF AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2009-10-29 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-20090270418-A1 PYRAZOLE PYRAZINE AMINE COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS THEREOF AND METHODS OF TREATMENT THEREWITH MAP3K1, MAP3K15, MAP3K5 PLK4 182/4885NTRK1 2610/4885BDKRB1 1600/4885

“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.