SCHEMBL4892529

SCHEMBL4892529

FC(F)(F)c1cccc(Nc2nccc(-c3ccnc(Cl)c3)n2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.65
CLK2 P49760 1/20 0.65
DYRK1A Q13627 1/20 0.65
CLK4 Q9HAZ1 1/20 0.65
DYRK1B Q9Y463 1/20 0.65
MTOR P42345 2/20 0.63
SMG1 Q96Q15 1/20 0.63
AURKA O14965 3/20 0.62
GSK3B P49841 4/20 0.56
CDK2 P24941 3/20 0.56
CDK4 P11802 2/20 0.56
PIM1 P11309 1/20 0.56
CCNA2 P20248 1/20 0.56
CCND3 P30281 1/20 0.56
CCNA1 P78396 1/20 0.56
CAMK2D Q13557 2/20 0.53
CTSC P53634 3/20 0.52
IDH2 P48735 1/20 0.51
KDM4E B2RXH2 1/20 0.51
PLK1 P53350 1/20 0.51

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
SCHEMBL27116471 0.87 CLK1 (0.66) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL4901590 0.86 ABL1 (0.67) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL2328646 0.86 CLK1 (0.65) CLK1CLK2DYRK1ACLK4DYRK1B
Nitric Acid SCHEMBL5734022 0.84 CLK1 (0.49) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL2329332 0.84 KDM4E (0.58) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL3513778 0.84 CAMK2D (0.73) MTORSMG1CDK2CDK4CCNA2
SCHEMBL2113984 0.83 AURKA (0.77) AURKACTSCIDH2KDM4E
SCHEMBL25336406 0.83 CAMK2D (0.69) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL30554563 0.83 CAMK2D (0.69) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL27115596 0.83 SYK (0.65) CLK1CLK2DYRK1ACLK4DYRK1B

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672042-B1 PHARMACOLOGICALLY ACTIVE PYRIMIDINEAMINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF NOVARTIS AG (CH) 2006-05-03 EP claimed
US-5705502-A Pharmacologically active pyrimidineamine derivatives and processes for the preparation thereof NOVARTIS CORPORATION (US) 1998-01-06 US claimed
EP-0672042-A1 PHARMACOLOGICALLY ACTIVE PYRIMIDINEAMINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Novartis AG (CH) 1995-09-20 EP claimed
WO-1995009851-A1 PHARMACOLOGICALLY ACTIVE PYRIMIDINEAMINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF CIBA-GEIGY AG (CH) 1995-04-13 WO claimed
US-20080187575-A1 Pyrimidine Derivatives VICHEM CHEMIE KFT (HU) 2008-08-07 US disclosed
EP-1786781-A2 PYRIMIDINE DERIVATIVES GPC Biotech AG (DE) 2007-05-23 EP disclosed
WO-2006021458-A2 PYRIMIDINE DERIVATIVES GPC BIOTECH AG (DE) 2006-03-02 WO disclosed
EP-0672041-B1 PHARMACOLOGICALLY ACTIVE PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF NOVARTIS AG (CH) 2001-11-14 EP disclosed
WO-1999035140-A1 PYRIDINYLPYRIMIDINE AMINES AS IMMUNOGLOBULINE E (IgE) SYNTHESIS INHIBITORS NOVARTIS AG (CH) 1999-07-15 WO disclosed
US-5728708-A ANTITUMOR AGENTS NOVARTIS CORPORATION (US) 1998-03-17 US disclosed
EP-0672041-A1 PHARMACOLOGICALLY ACTIVE PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Novartis AG (CH) 1995-09-20 EP disclosed
WO-1995009853-A1 PHARMACOLOGICALLY ACTIVE PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF CIBA-GEIGY AG (CH) 1995-04-13 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-20080187575-A1 Pyrimidine Derivatives TYMP, TDP1, PNP CLK1 3275/4885CLK2 2309/4885DYRK1A 2823/4885

“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.