SCHEMBL4695486

SCHEMBL4695486

CC(=O)c1cccc(-c2cnc3ccc(NCCCN4CCOCC4)nn23)c1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FYN P06241 16/20 0.72
PIM1 P11309 2/20 0.63
PIM2 Q9P1W9 1/20 0.63
CAMK2D Q13557 1/20 0.55
BRAF P15056 1/20 0.51

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
SCHEMBL13234249 0.90 FYN (0.70) FYNPIM1
SCHEMBL4695075 0.86 PIM1 (0.65) FYNPIM1CAMK2D
SCHEMBL4696679 0.85 PIM1 (0.67) FYNPIM1CAMK2D
SCHEMBL3642279 0.85 PIM1 (0.64) FYNPIM1
SCHEMBL3648939 0.85 PIM1 (0.62) FYNPIM1
SCHEMBL18613660 0.84 FYN (1.00) FYNPIM1PIM2
Hydrochloric Acid SCHEMBL3452909 0.84 PIM1 (0.61) FYNPIM1
SCHEMBL4695605 0.82 FYN (1.00) FYNPIM1PIM2
SCHEMBL1054955 0.82 PIM1 (0.62) FYNPIM1
SCHEMBL4695427 0.81 FYN (0.65) FYNPIM1PIM2CAMK2D

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-1900739-A1 Diazolodiazine derivatives as kinase inhibitors CELLZOME AG (DE) 2008-03-19 EP claimed
WO-2008025822-A1 DIAZOLODIAZINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2008-03-06 WO claimed
EP-1900739-A1 Diazolodiazine derivatives as kinase inhibitors CELLZOME AG (DE) 2008-03-19 EP disclosed
WO-2008025822-A1 DIAZOLODIAZINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2008-03-06 WO disclosed