SCHEMBL10051252

SCHEMBL10051252

CC(=O)OCc1ccc(NC(=O)C(CCCNC(N)=O)NC(=O)C(N)C(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 11/20 0.43
SIRT1 Q96EB6 11/20 0.43
SIRT3 Q9NTG7 3/20 0.43
SIRT5 Q9NXA8 3/20 0.43
NPY4R P50391 2/20 0.40
NPY1R P25929 1/20 0.40
HTT P42858 1/20 0.39

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
SCHEMBL16455129 1.00 SIRT2 (0.43) SIRT2SIRT1SIRT3SIRT5NPY4R
SCHEMBL14887385 1.00 SIRT2 (0.43) SIRT2SIRT1SIRT3SIRT5NPY4R
SCHEMBL17236056 1.00 SIRT2 (0.43) SIRT2SIRT1SIRT3SIRT5NPY4R
SCHEMBL24094770 0.93 SIRT2 (0.44) SIRT2SIRT1SIRT3SIRT5NPY4R
SCHEMBL20442348 0.92 SIRT2 (0.45) SIRT2SIRT1SIRT3SIRT5NPY4R
SCHEMBL18823483 0.92 SIRT2 (0.43) SIRT2SIRT1SIRT3SIRT5NPY4R
SCHEMBL22507679 0.92 SIRT2 (0.43) SIRT2SIRT1SIRT3SIRT5NPY4R
SCHEMBL19456862 0.91 SIRT2 (0.42) SIRT2SIRT1SIRT3SIRT5NPY4R
SCHEMBL24224697 0.91 SIRT2 (0.42) SIRT2SIRT1SIRT3SIRT5NPY4R
SCHEMBL15606256 0.91 SIRT2 (0.42) SIRT2SIRT1SIRT3SIRT5NPY4R

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
WO-2014151030-A1 CELL PROLIFERATION INHIBITORS AND CONJUGATES THEREOF NOVARTIS AG (CH) 2014-09-25 WO disclosed
EP-1926757-B1 ANTIBODY-COMB POLYMER CONJUGATE UCB PHARMA SA (BE) 2012-02-22 EP disclosed