SCHEMBL3928024

SCHEMBL3928024

CCN1CCC(N[C]=O)C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
EPHX1 P07099 1/20 0.36
EPHX2 P34913 1/20 0.36
RECQL P46063 1/20 0.34
KDM4E B2RXH2 4/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
DRD4 P21917 1/20 0.32
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HRH2 P25021 1/20 0.30
HRH1 P35367 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL3926636 0.89 GAA (0.40) KDM4EGAA
SCHEMBL1781918 0.88 SMN1; SMN2 (0.42) SMN1; SMN2EPHX1EPHX2RECQLKDM4E
SCHEMBL2549878 0.75
SCHEMBL13832821 0.75
SCHEMBL15079109 0.75
SCHEMBL20028208 0.74 BCHE (0.39) SMN1; SMN2EPHX1EPHX2RECQLKDM4E
SCHEMBL19706224 0.74
SCHEMBL771082 0.74
SCHEMBL9146256 0.74 BCHE (0.39) SMN1; SMN2EPHX1EPHX2RECQLKDM4E
SCHEMBL15500341 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009007390-A2 2-PYRAZ INYLBENZ IMIDAZOLE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2009-01-15 WO disclosed