SCHEMBL16847607

SCHEMBL16847607

C=CCOC(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)Nc1ccc(CO[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.49
▸ TDP1 Q9NUW8 5/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ GLA P06280 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ PAX8 Q06710 1/20 0.49
▸ NPSR1 Q6W5P4 3/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ SIRT2 Q8IXJ6 8/20 0.45
▸ SIRT1 Q96EB6 7/20 0.45
▸ SIRT3 Q9NTG7 3/20 0.45
▸ SIRT5 Q9NXA8 3/20 0.45
▸ TGM2 P21980 1/20 0.44

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
SCHEMBL19017845 0.88 MAPT (0.49) MAPTTDP1KDM4EGLAGAA
SCHEMBL16847608 0.88 MAPT (0.49) MAPTTDP1KDM4EGLAGAA
SCHEMBL17650866 0.86 CA1 (0.50) MAPTTDP1KDM4EGLAGAA
SCHEMBL16424794 0.84 CA1 (0.47) MAPTTDP1KDM4EGLAGAA
SCHEMBL12285414 0.81 PSMB8 (0.47) MAPTTDP1PAX8NPSR1CA1
SCHEMBL16424793 0.78 MDM2 (0.44) MAPTTDP1KDM4EGLAGAA
SCHEMBL28074876 0.77 CA1 (0.57) MAPTTDP1KDM4EGLAGAA
SCHEMBL14378788 0.77 CA1 (0.59) MAPTTDP1KDM4EGLAGAA
SCHEMBL14950097 0.77 SIRT5 (0.42) MAPTTDP1KDM4EGLAGAA
SCHEMBL18332009 0.77 CA1 (0.45) MAPTTDP1KDM4EGLAGAA

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-2015095227-A2 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH, INC. (US) 2015-06-25 — — WO disclosed
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