SCHEMBL2933201

SCHEMBL2933201

O=C(NC[C@H](O)CO)c1ccc(-c2cncc(-c3cc4ccccc4[nH]3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
CNR2 P34972 1/20 0.45
CDK5 Q00535 6/20 0.44
CDK5R1 Q15078 6/20 0.44
ULK1 O75385 2/20 0.40
ATR Q13535 2/20 0.39
ITK Q08881 3/20 0.39
ACSS2 Q9NR19 2/20 0.39
PRF1 P14222 1/20 0.39
RIPK1 Q13546 1/20 0.38
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38

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
SCHEMBL2927851 1.00 KDM4E (0.50) KDM4EALDH1A1HPGDCNR2CDK5
SCHEMBL13515298 1.00 KDM4E (0.50) KDM4EALDH1A1HPGDCNR2CDK5
SCHEMBL2933637 0.79 CDK5 (0.55) KDM4EALDH1A1HPGDCDK5CDK5R1
SCHEMBL2928266 0.73 ALDH1A1 (0.55) KDM4EALDH1A1ATRITK
SCHEMBL2933583 0.72 ITK (0.45) KDM4EALDH1A1HPGDCDK5CDK5R1
SCHEMBL27745020 0.72 CDK5 (0.46) KDM4ECDK5CDK5R1ATRITK
SCHEMBL2928726 0.72 ALDH1A1 (0.37) ALDH1A1CDK5CDK5R1ATRITK
SCHEMBL17422799 0.71 CDK5 (0.57) KDM4EALDH1A1HPGDCDK5CDK5R1
SCHEMBL2928728 0.71 CYP2C9 (0.50) KDM4EALDH1A1ITK
SCHEMBL2930486 0.71 CDK5 (0.44) CDK5CDK5R1ATRITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP claimed
CN-101472912-A Pyridine and pyrazine derivatives as MNK kinase inhibitors BIOVITRUM AB PUBL (SE) 2009-07-01 CN claimed
EP-2044051-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (publ) (SE) 2009-04-08 EP claimed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US claimed
WO-2007147874-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (PUBL) (SE) 2007-12-27 WO claimed
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
CN-101472912-A Pyridine and pyrazine derivatives as MNK kinase inhibitors BIOVITRUM AB PUBL (SE) 2009-07-01 CN disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 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-20080039450-A1 Compounds NEK2, CSNK2A3, CSNK2A1 KDM4E 2380/4885ALDH1A1 3748/4885HPGD 3066/4885

“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.