SCHEMBL2932963

SCHEMBL2932963

CN1CCN(C(=O)c2ccc(Nc3cncc(-c4ccc(C(N)=O)cc4)n3)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.58
RAF1 P04049 1/20 0.55
BRAF P15056 1/20 0.55
MKNK1 Q9BUB5 1/20 0.53
MKNK2 Q9HBH9 1/20 0.53
ATR Q13535 1/20 0.50
CDK2 P24941 3/20 0.49
CCNE2 O96020 1/20 0.49
CCNE1 P24864 1/20 0.49
GSK3B P49841 1/20 0.49
SRC P12931 3/20 0.46
EPHB4 P54760 1/20 0.46
POLB P06746 1/20 0.45
BTK Q06187 1/20 0.45
CAMK2D Q13557 1/20 0.45
HPGD P15428 1/20 0.44
CCNT1 O60563 1/20 0.44
CDK4 P11802 1/20 0.44
CCND1 P24385 1/20 0.44
CDK9 P50750 1/20 0.44

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
Trifluoroacetic Acid SCHEMBL2928619 0.93 CHEK1 (0.52) CHEK1RAF1BRAFMKNK1MKNK2
SCHEMBL2928621 0.86 ATR (0.52) CHEK1BRAFMKNK1MKNK2ATR
SCHEMBL2935041 0.82 KDR (0.47) CHEK1RAF1BRAFSRCBTK
SCHEMBL2932639 0.80 POLB (0.53) CDK2SRCPOLBCCNT1CDK4
SCHEMBL2931418 0.79 SRC (0.49) BRAFMKNK1MKNK2ATRCDK2
SCHEMBL4996944 0.78 BRAF (0.64) CHEK1RAF1BRAFMKNK1MKNK2
SCHEMBL13515277 0.76 FASN (0.50) CHEK1BRAFMKNK1MKNK2ATR
SCHEMBL2931520 0.76 HRH4 (0.55) CDK2CCNE1SRCEPHB4BTK
SCHEMBL19237065 0.76 LDHA (0.59) CHEK1MKNK1MKNK2ATRCDK2
SCHEMBL2932525 0.75 LRRK2 (0.46) CHEK1BRAFMKNK1MKNK2ATR

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
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
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
WO-2007147874-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (PUBL) (SE) 2007-12-27 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-20080039450-A1 Compounds NEK2, CSNK2A3, CSNK2A1 CHEK1 162/4885RAF1 122/4885BRAF 524/4885

“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.