SCHEMBL4050258

SCHEMBL4050258

CCN1CCC(Oc2cc(-c3cccc(-c4ccccc4)c3)c3nccn3n2)C1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.36
CHRM3 P20309 5/20 0.36
ADORA2A P29274 1/20 0.35
PRMT3 O60678 1/20 0.34
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
PRMT8 Q9NR22 1/20 0.34
ESR1 P03372 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
PDE10A Q9Y233 1/20 0.33

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
SCHEMBL3867949 0.80 FAAH (0.37)
SCHEMBL4056269 0.80 FAAH (0.37) SYKCHRM3
SCHEMBL4048771 0.76 GABRA1 (0.44) SYK
SCHEMBL4050256 0.74 PDE10A (0.41) ADORA2APRMT3CARM1PRMT6PRMT8
SCHEMBL3866450 0.72 PIM1 (0.52)
SCHEMBL3869035 0.66 PIM1 (0.48)
SCHEMBL16215600 0.65 CARM1 (0.57) CHRM3CARM1PRMT6ESR1
SCHEMBL3871956 0.64 MKNK1 (0.40) CHRM3
SCHEMBL25502832 0.64 ADORA2A (0.44) ADORA2A
SCHEMBL8437406 0.63 CYP3A4 (0.48) PDE3BPDE3APDE10A

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