SCHEMBL7307559

SCHEMBL7307559

CC(C)C[C@H](N)C(=O)NC(=O)C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 1/20 0.40
SLC7A5 Q01650 1/20 0.40
CTSD P07339 1/20 0.40
MAPK1 P28482 1/20 0.39
TSHR P16473 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
EPHX1 P07099 2/20 0.39
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL10829572 0.86 PSMB5 (0.51) PSMB5SMN1; SMN2GAAALOX15CTSD
SCHEMBL10829697 0.81 PSMB5 (0.47) PSMB5SMN1; SMN2SLC7A5CTSDMAPK1
SCHEMBL30085015 0.78 SLC7A5 (0.47) PSMB5SLC7A5TSHREPHX1DPP4
Hydrochloric Acid SCHEMBL11168293 0.77 PRCP (0.38) SLC7A5TSHRDPP4DPP8DPP9
SCHEMBL7307570 0.77 EPHX1 (0.56) SMN1; SMN2GAATSHRMEN1KMT2A
SCHEMBL5752738 0.76 PRCP (0.43) SLC7A5DPP4DPP8DPP9DPP7
SCHEMBL5751421 0.76 PRCP (0.43) SLC7A5DPP4DPP8DPP9DPP7
SCHEMBL10377188 0.76 TSHR (0.43) SMN1; SMN2CTSDMAPK1TSHRMEN1
SCHEMBL25468260 0.75 HDAC8 (0.44) SMN1; SMN2HDAC8HDAC6GAATSHR
SCHEMBL13995144 0.75 EPHX1 (0.53) SMN1; SMN2GAASLC7A5TSHRMEN1

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
US-5214056-A Thiol protease inhibitors JAPAN TOBACCO INC. (JP) 1993-05-25 US disclosed
EP-0460239-A1 1,3,2-DIOXATHIOLANE OXIDE DERIVATIVE Japan Tobacco Inc. (JP) 1991-12-11 EP disclosed