SCHEMBL2932811

SCHEMBL2932811

O=C(O)c1ccc(Nc2cncc(Cl)n2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 3/20 0.66
NPC1 O15118 3/20 0.55
RAB9A P51151 3/20 0.55
AURKA O14965 3/20 0.50
AURKB Q96GD4 1/20 0.47
HCAR3 P49019 1/20 0.46
KDR P35968 2/20 0.46
EGFR P00533 1/20 0.46
CCNB2 O95067 1/20 0.44
CCNE2 O96020 1/20 0.44
CDK1 P06493 1/20 0.44
CDK4 P11802 1/20 0.44
CCNB1 P14635 1/20 0.44
CCND1 P24385 1/20 0.44
CCNE1 P24864 1/20 0.44
CCNB3 Q8WWL7 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
BRAF P15056 1/20 0.43
ATM Q13315 1/20 0.43
PIM3 Q86V86 2/20 0.43

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
SCHEMBL6657536 0.82 HCAR3 (0.55) CDK2HCAR3
SCHEMBL6661698 0.80 CDK2 (0.69) CDK2AURKASMN1; SMN2BRAFPOLB
SCHEMBL6656588 0.80 BRAF (0.62) CDK2SMN1; SMN2BRAFPOLBMAPT
SCHEMBL2885798 0.80 CDK2 (0.73) CDK2NPC1RAB9AKDREGFR
SCHEMBL1678613 0.80 CDK2 (1.00) CDK2RAB9ABRAFMAPTMAPK1
SCHEMBL2933640 0.80 CDK2 (0.48) CDK2AURKAPIM3MAPTKMT2A
SCHEMBL2930125 0.80 CDK2 (0.55) CDK2AURKAAURKBSMN1; SMN2POLB
SCHEMBL2930251 0.77 CDK2 (0.52) CDK2EGFRPIM3POLBMAPT
SCHEMBL2929139 0.77 AKR1C3 (0.46) CDK2NPC1RAB9AKDRSMN1; SMN2
SCHEMBL6302354 0.77 CDK2 (0.69) CDK2NPC1RAB9AAURKAKDR

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
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
EP-2044051-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (publ) (SE) 2009-04-08 EP 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 CDK2 182/4885NPC1 1393/4885RAB9A 1528/4885

“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.