SCHEMBL2925834

SCHEMBL2925834

CN(C)CCCN1CCN(C(=O)c2ccc(-c3cncc(-c4cc5ccccc5[nH]4)n3)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.43
VCP P55072 1/20 0.43
DRD3 P35462 6/20 0.42
DRD2 P14416 5/20 0.42
SLC2A1 P11166 1/20 0.42
SYK P43405 1/20 0.42
HRH4 Q9H3N8 2/20 0.41
RIPK1 Q13546 1/20 0.41
ATR Q13535 2/20 0.41
NAMPT P43490 1/20 0.40
PLA2G2A P14555 1/20 0.40

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
SCHEMBL2927770 0.83 CDK2 (0.47) KDRVCPDRD3DRD2SYK
SCHEMBL2930486 0.80 CDK5 (0.44) ATR
SCHEMBL2927882 0.80 RIPK1 (0.55) KDRRIPK1ATR
Hydrochloric Acid SCHEMBL2935656 0.79 RIPK1 (0.54) KDRRIPK1ATR
Trifluoroacetic Acid SCHEMBL4890779 0.79 CDK2 (0.43) KDRVCPDRD3DRD2SYK
SCHEMBL2927344 0.77 SYK (0.44) DRD3DRD2SYKHRH4
SCHEMBL602678 0.77 HRH4 (0.69) DRD3DRD2HRH4
SCHEMBL2929125 0.76 ACKR3 (0.40) VCPDRD3DRD2SYKHRH4
SCHEMBL2933623 0.74 ATR (0.46) KDRATR
SCHEMBL2929192 0.74 SYK (0.40) KDRSYKHRH4

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 10 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
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
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 KDR 3834/4885VCP 2810/4885DRD3 2932/4885

“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.