SCHEMBL1869393

SCHEMBL1869393

CC(C)CN(C)C(=O)N(C(C)C)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.38
CA12 O43570 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
MLYCD O95822 1/20 0.33
PIK3CD O00329 1/20 0.32
TAS2R14 Q9NYV8 1/20 0.31

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
SCHEMBL11912101 0.85 CA1 (0.44) CA1CA12CA2CA9MLYCD
SCHEMBL12884951 0.81 CA1 (0.38) CA1CA12CA2CA9TAS2R14
SCHEMBL1876140 0.76 CA12 (0.30) CA1CA12CA2CA9
SCHEMBL8439081 0.73 P2RX4 (0.33)
SCHEMBL469484 0.72
SCHEMBL19924641 0.72
SCHEMBL967356 0.72
SCHEMBL967357 0.72
SCHEMBL4873108 0.71 ALDH1A1 (0.39)
SCHEMBL1871942 0.70 S1PR1 (0.40) PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103025770-B Catalyst component for the polymerization of olefins having a guanidinate ligand DSM IP ASSETS BV 2015-06-24 CN disclosed
US-8987393-B2 Catalyst component for the polymerization of olefins having a guanidinate ligand LANXESS ELASTOMERS B.V. (NL) 2015-03-24 US disclosed
CN-103025770-A Catalyst component for the polymerization of olefins having a guanidinate ligand DSM IP ASSETS BV 2013-04-03 CN disclosed
US-20130079478-A1 CATALYST COMPONENT FOR THE POLYMERIZATION OF OLEFINS HAVING A GUANIDINATE LIGAND LANXESS ELASTOMERS B.V. 2013-03-28 US disclosed
EP-2496612-A1 CATALYST COMPONENT FOR THE POLYMERIZATION OF OLEFINS HAVING A GUANIDINATE LIGAND Lanxess Elastomers B.V. (NL) 2012-09-12 EP disclosed
WO-2011054927-A1 CATALYST COMPONENT FOR THE POLYMERIZATION OF OLEFINS HAVING A GUANIDINATE LIGAND DSM IP ASSETS B.V. (NL) 2011-05-12 WO disclosed