SCHEMBL10649367

SCHEMBL10649367

CC(=O)NC1CN(OC(C)=O)C1=O.c1cc2cc-2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
IRAK4 Q9NWZ3 2/20 0.35
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PRKDC P78527 1/20 0.33
IRAK1 P51617 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
KMT2A Q03164 1/20 0.32
OGA O60502 1/20 0.32
CKS1B P61024 1/20 0.32
SKP1 P63208 1/20 0.32

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
SCHEMBL10758102 0.87 PSMB5 (0.36) KDM4EMAPTLMNAPOLBALDH1A1
SCHEMBL10653301 0.80 IRAK4 (0.37) KDM4EMAPTLMNAPOLBIRAK4
SCHEMBL10763355 0.77 PTGDR2 (0.41) KDM4EMAPTLMNAALDH1A1THRB
SCHEMBL11079176 0.76 CA1 (0.37) KDM4EMAPTLMNAPOLBIRAK4
SCHEMBL10757168 0.75 PTGS1 (0.43) KDM4EMAPTLMNAPOLBALDH1A1
SCHEMBL10762064 0.75 PSMB5 (0.38) KDM4EMAPTLMNAPOLBALDH1A1
SCHEMBL8894148 0.75 POLB (0.45) MAPTPOLBKMT2A
SCHEMBL8895550 0.75 MEN1 (0.34) KDM4EMAPTLMNAPOLBIRAK4
SCHEMBL10860123 0.75 ACE (0.42) KDM4EALDH1A1
SCHEMBL10545523 0.74 CA1 (0.38) KDM4EMAPTLMNAPOLBIRAK4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0123442-B1 IMPROVEMENTS IN OR RELATING TO A PROCESS FOR PRODUCING BETA-LACTAM COMPOUNDS THE UNIVERSITY OF NOTRE DAME DU LAC (US) 1988-06-15 EP disclosed
US-4675399-A N-HYDROXY-2-AZETIDINONES; ACYLATION, SOLVOLYSIS NOTRE DAME UNIVERSITY (US) 1987-06-23 US disclosed
US-4565654-A BETA-LACTAMASE ENZYME INHIBITORS UNIVERSITY OF NOTRE DAME DU LAC (US) 1986-01-21 US disclosed
EP-0123442-A1 Improvements in or relating to a process for producing beta-lactam compounds THE UNIVERSITY OF NOTRE DAME DU LAC (US) 1984-10-31 EP disclosed