SCHEMBL19982696

SCHEMBL19982696

CC(C)CC(NC(=O)[C@@H](N)CCc1ccccc1)C(N)=O

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ERAP2 Q6P179 13/20 0.65
ERAP1 Q9NZ08 13/20 0.65
LNPEP Q9UIQ6 11/20 0.65
IL1RN P18510 3/20 0.57
MMP3 P08254 1/20 0.52
FCER2 P06734 2/20 0.51
MMP1 P03956 1/20 0.51
ANPEP P15144 1/20 0.50
LTA4H P09960 1/20 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
SCHEMBL17706116 0.91 LTA4H (0.61) ERAP2ERAP1LNPEPMMP3ANPEP
Hydrochloric Acid SCHEMBL15634708 0.90 LTA4H (0.60) ERAP2ERAP1LNPEPMMP3ANPEP
Hydrochloric Acid SCHEMBL15634706 0.90 LTA4H (0.60) ERAP2ERAP1LNPEPMMP3ANPEP
SCHEMBL15581362 0.88 ERAP2 (0.64) ERAP2ERAP1LNPEPIL1RNMMP3
SCHEMBL14441431 0.88 CTSC (0.51) ERAP2ERAP1LNPEPIL1RNMMP3
SCHEMBL22130539 0.87 ERAP2 (0.62) ERAP2ERAP1LNPEPIL1RNMMP3
SCHEMBL15581384 0.87 ERAP2 (0.55) ERAP2ERAP1LNPEPMMP3LTA4H
SCHEMBL2487473 0.86 LTA4H (0.62) ERAP2ERAP1LNPEPMMP3FCER2
SCHEMBL12057953 0.86 LTA4H (0.62) ERAP2ERAP1LNPEPMMP3FCER2
SCHEMBL12038997 0.86 LTA4H (0.62) ERAP2ERAP1LNPEPMMP3FCER2

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-3512835-B1 A PROCESS FOR PURIFICATION OF CARFILZOMIB INTERMEDIATE FRESENIUS KABI ONCOLOGY LTD (IN) 2021-06-09 EP disclosed
WO-2018051237-A1 A PROCESS FOR PURIFICATION OF CARFILZOMIB INTERMEDIATE FRESENIUS KABI ONCOLOGY LIMITED (IN) 2018-03-22 WO disclosed