SCHEMBL2012384

SCHEMBL2012384

CCN1CC(C)(C)OC(=O)C1C(Cc1ccccc1C)C(N)=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
DPP4 P27487 4/20 0.33
DPP8 Q6V1X1 3/20 0.33
DPP9 Q86TI2 3/20 0.33
FAP Q12884 2/20 0.33
P2RX7 Q99572 2/20 0.33
DPP7 Q9UHL4 1/20 0.33
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PARP1 P09874 1/20 0.31

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
SCHEMBL2013234 0.71 ALDH1A1 (0.47) P2RX7ALDH1A1MEN1KMT2A
SCHEMBL17101190 0.62 KMT2A (0.46) DPP4DPP8DPP9FAPDPP7
SCHEMBL363390 0.61 PPARG (0.43) DPP4DPP8DPP9FAPDPP7
SCHEMBL10483592 0.61 DPP4 (0.48) DPP4DPP8DPP9FAPDPP7
SCHEMBL2013353 0.60 CACNA1G (0.45) ALDH1A1MEN1KMT2A
SCHEMBL27559397 0.60 KMT2A (0.51) DPP4DPP7ALDH1A1KMT2A
SCHEMBL29187310 0.60 PPARG (0.46) DPP4DPP8DPP9FAPDPP7
SCHEMBL26076505 0.60 PPARG (0.46) DPP4DPP8DPP9FAPDPP7
SCHEMBL7437418 0.59 KMT2A (0.58) ALDH1A1KMT2A
SCHEMBL5607417 0.58 DPP4 (0.42) DPP4DPP8DPP9FAPDPP7

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-2513069-A1 ANTIFUNGAL COMPOUNDS Katholieke Universiteit Leuven (BE) 2012-10-24 EP disclosed
WO-2011072345-A1 ANTIFUNGAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2011-06-23 WO disclosed