SCHEMBL9829615

SCHEMBL9829615

O=C(O)CCNC(=O)CNC(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
PRSS1 P07477 1/20 0.56
CTSG P08311 1/20 0.56
CTRB1 P17538 1/20 0.56
CMA1 P23946 1/20 0.56
KDM4E B2RXH2 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
GPR139 Q6DWJ6 1/20 0.53
TSHR P16473 1/20 0.52
RECQL P46063 1/20 0.52
HDAC3 O15379 2/20 0.50
HDAC4 P56524 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC7 Q8WUI4 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC10 Q969S8 2/20 0.50
HDAC11 Q96DB2 2/20 0.50
HDAC8 Q9BY41 2/20 0.50

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
SCHEMBL8770814 0.87 MAPK1 (0.69) GAAMEN1KMT2ATSHRHDAC3
Betamipron SCHEMBL605899 0.87 PRSS1 (0.70) GAAKMT2APRSS1CTSGCTRB1
Betamipron SCHEMBL4498475 0.87 PRSS1 (0.70) GAAKMT2APRSS1CTSGCTRB1
SCHEMBL26198577 0.84 GAA (0.58) GAAMEN1KMT2APRSS1CTSG
SCHEMBL7515133 0.84 KDM4E (0.59) GAAMEN1KMT2AKDM4ENPSR1
SCHEMBL7293621 0.84 KDM4E (0.59) GAAMEN1KMT2AKDM4ENPSR1
SCHEMBL9545406 0.83 NAAA (0.58) GAAMEN1KMT2AGPR139TSHR
SCHEMBL23489465 0.81 GAA (0.48) GAAMEN1KMT2AGPR139SMN1; SMN2
SCHEMBL18395719 0.81 HDAC3 (0.52) GAAMEN1KMT2APRSS1CTSG
SCHEMBL18395724 0.81 HDAC3 (0.52) GAAMEN1KMT2APRSS1CTSG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1036832-C Composition containing a penem or carbapenem artibiotic and the use of the same SANKYO CO (JP) 1997-12-31 CN claimed
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP claimed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US claimed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP claimed
CN-86107574-A Compositions containing penem or carbapenem antibiotics and their use 1987-05-20 CN claimed
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed