SCHEMBL19647271

SCHEMBL19647271

CC(=O)C(CCCCN)NC(=O)C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 1/20 0.42
▸ SIRT1 Q96EB6 1/20 0.42
▸ FOLH1 Q04609 1/20 0.41
▸ MMP1 P03956 4/20 0.40
▸ MMP3 P08254 4/20 0.40
▸ CTSK P43235 1/20 0.40
▸ MMP9 P14780 3/20 0.39
▸ GRIA1 P42261 1/20 0.39
▸ CPB2 Q96IY4 1/20 0.38

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
SCHEMBL24824249 0.90 HPGDS (0.42) SIRT6SIRT1FOLH1CTSKGRIA1
SCHEMBL13049083 0.86 FOLH1 (0.57) FOLH1MMP9CPB2
SCHEMBL29187387 0.86 FOLH1 (0.57) FOLH1MMP9CPB2
SCHEMBL23615418 0.83 FOLH1 (0.40) SIRT6SIRT1FOLH1MMP1MMP3
Hydrochloric Acid SCHEMBL28675933 0.82 CTSK (0.43) FOLH1CTSKCPB2
Hydrochloric Acid SCHEMBL28675934 0.82 CTSK (0.43) FOLH1CTSKCPB2
SCHEMBL20435077 0.82 SIRT6 (0.58) SIRT6SIRT1FOLH1
SCHEMBL12749404 0.82 SIRT6 (0.58) SIRT6SIRT1FOLH1
SCHEMBL20435058 0.82 SIRT6 (0.58) SIRT6SIRT1FOLH1
SCHEMBL16589724 0.81 SIRT6 (0.55) SIRT6SIRT1MMP1MMP3MMP9

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
EP-2780039-B1 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF PFIZER (US) 2017-11-29 — — EP disclosed
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