SCHEMBL17536213

SCHEMBL17536213

CC(C)N=C(NC(C)C)C(=O)[O-].CC(C)N=C(NC(C)C)C(=O)[O-].[Mn+2]

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.30
GAA P10253 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
SCHEMBL2941025 0.96 CA12 (0.32) CA12CA1CA2MMP1MMP2
SCHEMBL3290634 0.96 ALDH1A1 (0.34) CA12CA1CA2MMP1MMP2
SCHEMBL2944909 0.96 CA12 (0.32) CA12CA1CA2MMP1MMP2
SCHEMBL3926609 0.96 CA12 (0.32) CA12CA1CA2MMP1MMP2
Lithium Ion SCHEMBL1005375 0.96 CA12 (0.32) CA12CA1CA2MMP1MMP2
SCHEMBL1785154 0.96 CA12 (0.32) CA12CA1CA2MMP1MMP2
SCHEMBL2157672 0.96 CA12 (0.32) CA12CA1CA2MMP1MMP2
SCHEMBL3290453 0.96 CA12 (0.32) CA12CA1CA2MMP1MMP2
Carbon Monoxide SCHEMBL3924423 0.92 CA12 (0.30) CA12CA1CA2MMP1MMP2
SCHEMBL336859 0.77 ALDH1A1 (0.37) CA12CA1CA2MMP1MMP2

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-9460960-B2 Electric connection element manufacturing method STMICROELECTRONICS (TOURS) SAS (FR) 2016-10-04 US disclosed
US-20160064278-A1 ELECTRIC CONNECTION ELEMENT MANUFACTURING METHOD STMICROELECTRONICS (TOURS) SAS (FR) 2016-03-03 US disclosed