SCHEMBL4048774

SCHEMBL4048774

CC(Oc1ccc2nc(-c3cccc(-c4ccccc4)c3)cn2n1)C1CCCNC1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.38
GABRA1 P14867 2/20 0.34
GABRB2 P47870 2/20 0.34
WDR5 P61964 1/20 0.34
PIM1 P11309 2/20 0.33
PIM3 Q86V86 2/20 0.33
PIM2 Q9P1W9 2/20 0.33
JAK1 P23458 2/20 0.33
JAK3 P52333 2/20 0.33
IRAK4 Q9NWZ3 1/20 0.32
ACP1 P24666 1/20 0.32
JAK2 O60674 1/20 0.32
TYK2 P29597 1/20 0.32
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
MKNK1 Q9BUB5 2/20 0.32
PRKCZ Q05513 1/20 0.32
PRKD2 Q9BZL6 1/20 0.32

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
SCHEMBL3870154 0.81 MKNK1 (0.47) PIM1MKNK1
SCHEMBL4056288 0.79 CCNT1 (0.32) PIM1PIM3PIM2
SCHEMBL3865962 0.74 MKNK1 (0.47) PIM1MKNK1
SCHEMBL3869789 0.73 KDR (0.32) IRAK4MKNK1
SCHEMBL3868540 0.71 PIM1 (0.47) PIM1MKNK1
SCHEMBL3869751 0.71 PIM1 (0.54) PIM1
SCHEMBL4046562 0.71 FYN (0.53) PIM1PIM2
SCHEMBL3866313 0.70 DYRK3 (0.45) PIM1MKNK1
SCHEMBL3866139 0.70 PIM1 (0.50) PIM1IRAK4MKNK1
SCHEMBL4052174 0.70 AKT1 (0.44) PIM1PIM2MKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044071-A1 OOXO-SUBSTITUTED IMIDAZO[1,2b]PYRIDAZINES, PRODUCTION AND USE THEREOF AS DRUGS Bayer Schering Pharma Aktiengesellschaft (DE) 2009-04-08 EP claimed
WO-2007147646-A1 OXO-SUBSTITUTED IMIDAZO[1,2b]PYRIDAZINES, PRODUCTION AND USE THEREOF AS DRUGS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-12-27 WO claimed