SCHEMBL19203552

SCHEMBL19203552

CC(=O)CCOCCOCCNC(=S)N[C@H](C(=O)N[C@@H](CCCNC(N)=O)C(C)=O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 3/20 0.40
▸ SIRT2 Q8IXJ6 2/20 0.34
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ FURIN P09958 5/20 0.31
▸ C3AR1 Q16581 1/20 0.31
▸ GLP1R P43220 3/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ RXFP1 Q9HBX9 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
SCHEMBL19171240 0.92 SIRT5 (0.37) SIRT5SIRT2MEN1KMT2AFURIN
SCHEMBL18122900 0.85 SIRT5 (0.36) SIRT5SIRT2FURIN
SCHEMBL17381414 0.84 SIRT5 (0.39) SIRT5MEN1KMT2AFURINC3AR1
SCHEMBL19170447 0.83 SIRT5 (0.34) SIRT5SIRT2MEN1KMT2AMAPT
SCHEMBL24722146 0.81 SIRT5 (0.34) SIRT5SIRT2
SCHEMBL19170726 0.81 SIRT5 (0.42) SIRT5SIRT2KMT2AFURINC3AR1
SCHEMBL19171339 0.81 SIRT5 (0.42) SIRT5SIRT2KMT2AFURINC3AR1
SCHEMBL23586838 0.79 FURIN (0.39) SIRT5FURINC3AR1
SCHEMBL19170685 0.78 NMT2 (0.40) SIRT5FURIN
SCHEMBL21534501 0.78 SIRT5 (0.33) SIRT5FURIN

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
EP-3273998-B1 MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE REGENERON PHARMA (US) 2019-09-04 — — EP disclosed
WO-2017132173-A1 MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE REGENERON PHARMACEUTICALS, INC. (US) 2017-08-03 — — WO disclosed
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