SCHEMBL2928690

SCHEMBL2928690

O=C(O)c1ccc(Nc2cncc(-c3cc4cc(F)ccc4[nH]3)n2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.47
BCL6 P41182 1/20 0.43
BCOR Q6W2J9 1/20 0.43
PYGL P06737 2/20 0.41
PIM3 Q86V86 4/20 0.40
KDM4E B2RXH2 1/20 0.39
PDPK1 O15530 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
APEX1 P27695 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CCNA2 P20248 4/20 0.38
CDK2 P24941 4/20 0.38
TTK P33981 4/20 0.38
CDK5 Q00535 1/20 0.36

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
SCHEMBL2933784 0.89 PIM3 (0.42) AURKAPIM3KDM4EPDPK1ALDH1A1
SCHEMBL2935136 0.87 BCL6 (0.43) AURKABCL6BCORPYGLPIM3
SCHEMBL2928408 0.86 PIM3 (0.46) AURKAPYGLPIM3CCNA2CDK2
SCHEMBL2930393 0.85 CDK2 (0.44) CCNA2CDK2TTK
Trifluoroacetic Acid SCHEMBL2930403 0.83 CDK2 (0.41) AURKACCNA2CDK2TTK
SCHEMBL2931629 0.83 MAPT (0.40) KDM4EALDH1A1LMNATSHRCYP2C19
SCHEMBL2928649 0.82 PIM3 (0.39) AURKAPYGLPIM3KDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL2933159 0.81 MAPT (0.38) KDM4EALDH1A1LMNATSHRCYP2C19
SCHEMBL2933161 0.76 SYK (0.33) AURKACCNA2CDK2TTKSYK
SCHEMBL2929271 0.75 KDR (0.43) PIM3PIM1PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229384-A1 ORGANIC COMPOUNDS Speedel Experimenta AG (CH) 2010-09-22 EP disclosed
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
WO-2009071606-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-06-11 WO 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 AURKA 320/4885BCL6 4594/4885BCOR 3225/4885

“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.