SCHEMBL355597

SCHEMBL355597

CN(C)CC1CC(c2ccccc2)OC1=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.42
MAOB P27338 4/20 0.37
KDM4E B2RXH2 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
AR P10275 1/20 0.37
CYP19A1 P11511 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TSHR P16473 1/20 0.36
LTA4H P09960 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34

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
SCHEMBL9182756 0.82 MAOB (0.44) MAOBKDM4EADORA3ARCYP19A1
SCHEMBL10906645 0.79 MAOB (0.40) MAOBKDM4EADORA3ARCYP19A1
SCHEMBL8443836 0.78 MAOB (0.42) MAOBKDM4EADORA3ARCYP19A1
SCHEMBL8443833 0.78 MAOB (0.42) MAOBKDM4EADORA3ARCYP19A1
SCHEMBL11639941 0.76 GRM2 (0.44)
SCHEMBL5936332 0.73 TSHR (0.43) MAOBKDM4EADORA3ARCYP19A1
SCHEMBL18099888 0.73 TSHR (0.43) MAOBKDM4EADORA3ARCYP19A1
SCHEMBL6288848 0.73 TSHR (0.43) MAOBKDM4EADORA3ARCYP19A1
SCHEMBL13039624 0.72 TSHR (0.46) MAOBKDM4EADORA3ARCYP19A1
SCHEMBL23913784 0.72 CHRNA7 (0.47) METAP1

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-2042571-B1 Ink composition FUJIFILM CORP (JP) 2012-03-14 EP disclosed
US-20090088492-A1 INK COMPOSITION FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20090088492-A1 INK COMPOSITION FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
EP-2042571-A1 Ink composition Fujifilm Corporation (JP) 2009-04-01 EP disclosed