SCHEMBL7375829

SCHEMBL7375829

CC(C)CC(N)C(=O)NC1CCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.49
ARG1 P05089 3/20 0.44
ARG2 P78540 2/20 0.44
LMNA P02545 1/20 0.44
BLM P54132 1/20 0.44
SLC7A5 Q01650 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
HTT P42858 1/20 0.42
DPP4 P27487 1/20 0.41
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
SMYD3 Q9H7B4 1/20 0.41
MEN1 O00255 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
CASP6 P55212 1/20 0.40

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
SCHEMBL7375831 1.00 EPHX1 (0.49) EPHX1ARG1ARG2LMNABLM
SCHEMBL13995144 0.96 EPHX1 (0.53) EPHX1ARG1ARG2LMNABLM
SCHEMBL7307570 0.95 EPHX1 (0.56) EPHX1ARG1ARG2LMNABLM
SCHEMBL7373388 0.93 SLC7A5 (0.47) EPHX1ARG1ARG2LMNABLM
SCHEMBL7373390 0.93 SLC7A5 (0.47) EPHX1ARG1ARG2LMNABLM
SCHEMBL4078143 0.86 ARG1 (0.47) EPHX1ARG1ARG2LMNABLM
SCHEMBL17152290 0.85 ARG1 (0.42) EPHX1ARG1ARG2LMNABLM
SCHEMBL17152281 0.83 KDM4E (0.43) EPHX1ARG1ARG2LMNABLM
SCHEMBL17152227 0.83 ALDH1A1 (0.43) ARG1ARG2DPP4DPP8DPP9
SCHEMBL8001048 0.81 ANPEP (0.51) EPHX1SMN1; SMN2GAARAB9AHTT

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-0777646-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-06-11 EP disclosed
WO-1996006074-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-02-29 WO disclosed