SCHEMBL9355239

SCHEMBL9355239

CC(C)NC(=O)CCCCNC(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.57
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
GAA P10253 1/20 0.54
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
CAPN1 P07384 1/20 0.49
FAAH O00519 1/20 0.49
MAPK1 P28482 1/20 0.49
CYP3A4 P08684 1/20 0.48
CA1 P00915 6/20 0.48
CA2 P00918 6/20 0.48
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
EPHX2 P34913 1/20 0.46
CTSK P43235 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
CHRM2 P08172 2/20 0.41
CHRM4 P08173 2/20 0.41
CHRM5 P08912 2/20 0.41

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
SCHEMBL26346279 0.89 MEN1 (0.50) TDP1MEN1KMT2AGAAMAOA
SCHEMBL7375698 0.85 TDP1 (0.55) TDP1MEN1KMT2AGAAMAOA
SCHEMBL23569493 0.84 TDP1 (0.60) TDP1MEN1KMT2AGAAMAOA
SCHEMBL15502140 0.84 TDP1 (0.60) TDP1MEN1KMT2AGAAMAOA
SCHEMBL7207224 0.83 TDP1 (0.69) TDP1MEN1KMT2AGAAMAOA
SCHEMBL24813067 0.83 TDP1 (0.52) TDP1MEN1KMT2AGAAMAOA
SCHEMBL22149776 0.83 TDP1 (0.63) TDP1MEN1KMT2AGAAMAOA
SCHEMBL16620050 0.82 MEN1 (0.52) TDP1MEN1KMT2AGAAMAOA
SCHEMBL15373105 0.82 TDP1 (0.62) TDP1MEN1KMT2AGAAMAOA
SCHEMBL21164035 0.82 MEN1 (0.44) TDP1MEN1KMT2AGAAMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300189-B1 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1994-11-02 EP disclosed
US-5223489-A Treatment of ypertension and heart failure UJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-29 US disclosed
US-5142048-A Enzyme inhibitor; carbamoyl group-containing acids FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-08-25 US disclosed
US-4921855-A New Histidyl amino acid derivatives, and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-05-01 US disclosed
EP-0300189-A2 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-01-25 EP disclosed