SCHEMBL8907388

SCHEMBL8907388

CCOC(=O)C(C)(N)c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.44
MAPT P10636 3/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TSHR P16473 3/20 0.41
CYP1A2 P05177 2/20 0.41
ABCB11 O95342 1/20 0.41
CYP3A4 P08684 1/20 0.41
HTR2A P28223 1/20 0.41
PMP22 Q01453 1/20 0.41
PPARA Q07869 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
PIN1 Q13526 1/20 0.40
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
LMNA P02545 1/20 0.39
MMP8 P22894 1/20 0.39

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
SCHEMBL13070710 0.86 TSHR (0.40) CNR2MAPTTSHRCYP1A2ABCB11
SCHEMBL6135476 0.86 NPSR1 (0.50) MAPTNPC1RAB9ATSHRCYP1A2
SCHEMBL2490473 0.86 CYP3A4 (0.58) CNR2MAPTTSHRCYP1A2ABCB11
SCHEMBL6135621 0.86 NPSR1 (0.50) MAPTNPC1RAB9ATSHRCYP1A2
SCHEMBL204187 0.86 NPSR1 (0.50) MAPTNPC1RAB9ATSHRCYP1A2
SCHEMBL1455978 0.86 PIN1 (0.51) MAPTTSHRNPSR1PIN1SMN1; SMN2
SCHEMBL27752471 0.86 PIN1 (0.51) MAPTTSHRNPSR1PIN1SMN1; SMN2
SCHEMBL27731921 0.86 PIN1 (0.51) MAPTTSHRNPSR1PIN1SMN1; SMN2
SCHEMBL1509089 0.85 L3MBTL1 (0.51) MAPTNPC1RAB9ATSHRCYP1A2
SCHEMBL1972148 0.85 L3MBTL1 (0.51) MAPTNPC1RAB9ATSHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691278-A HERBICIDES KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1997-11-25 US disclosed