SCHEMBL9005013

SCHEMBL9005013

CN(C)C(=O)C1CCCCC1C(=O)N(C)C

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSB P07858 1/20 0.58
CTSS P25774 1/20 0.58
CTSK P43235 1/20 0.58
GLI1 P08151 1/20 0.43
EPHX1 P07099 1/20 0.41
DPP4 P27487 6/20 0.33
DPP9 Q86TI2 2/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
BCHE P06276 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
SCHEMBL9005007 1.00 CTSB (0.58) CTSBCTSSCTSKGLI1EPHX1
SCHEMBL9005010 1.00 CTSB (0.58) CTSBCTSSCTSKGLI1EPHX1
SCHEMBL23481605 0.91 CTSB (0.51) CTSBCTSSCTSK
SCHEMBL5909476 0.89 EPHX1 (0.54) CTSBCTSSCTSKGLI1EPHX1
SCHEMBL4760478 0.84 CTSB (0.46) CTSBCTSSCTSKGLI1EPHX1
SCHEMBL15232997 0.84 CTSB (0.46) CTSBCTSSCTSKGLI1EPHX1
SCHEMBL11441520 0.80 EPHX1 (0.50) CTSBCTSSCTSKGLI1EPHX1
SCHEMBL14086037 0.80 EPHX1 (0.50) CTSBCTSSCTSKGLI1EPHX1
SCHEMBL14086040 0.80 EPHX1 (0.50) CTSBCTSSCTSKGLI1EPHX1
SCHEMBL24358985 0.80 CTSB (0.47) CTSBCTSSCTSKGLI1EPHX1

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
US-5583261-A FOR APPLICATION TO PLANTS TO TREAT POWDERY MILDEW BRITISH TECHNOLOGY GROUP LTD. (GB) 1996-12-10 US disclosed
US-5464873-A Antigrowth agents BRITISH TECHNOLOGY GROUP LIMITED (GB) 1995-11-07 US disclosed