SCHEMBL9943449

SCHEMBL9943449

CCC1(C(=O)OC(C)(C)C)CN(C(=O)OC(C)(C)C)CC1N

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.40
RORC P51449 5/20 0.37
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DDB1 Q16531 2/20 0.35
CRBN Q96SW2 2/20 0.35
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
HPGD P15428 1/20 0.34
EPHX2 P34913 1/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
DPP4 P27487 1/20 0.33
KDM1A O60341 1/20 0.33
NAMPT P43490 1/20 0.33

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
SCHEMBL9943448 0.89 NR1H2 (0.40) NR1H2RORCUSP2SMN1; SMN2DDB1
SCHEMBL28943366 0.78 NR1H2 (0.40) NR1H2RORCUSP2SMN1; SMN2DDB1
SCHEMBL29422982 0.77 NR1H2 (0.39) NR1H2RORCUSP2SMN1; SMN2DDB1
SCHEMBL29560344 0.76 NR1H2 (0.41) NR1H2RORCUSP2SMN1; SMN2DDB1
SCHEMBL700726 0.76 HPGD (0.41) USP2SMN1; SMN2HPGDDPP4KDM1A
SCHEMBL716216 0.76 HPGD (0.41) USP2SMN1; SMN2HPGDDPP4KDM1A
SCHEMBL14801889 0.75 NR1H2 (0.34) NR1H2RORCUSP2SMN1; SMN2MEN1
SCHEMBL24231705 0.75 NR1H2 (0.42) NR1H2RORCUSP2SMN1; SMN2DDB1
SCHEMBL21748741 0.75 NR1H2 (0.42) NR1H2RORCUSP2SMN1; SMN2DDB1
SCHEMBL21597767 0.75 NR1H2 (0.42) NR1H2RORCUSP2SMN1; SMN2DDB1

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
EP-2227460-B1 THERAPEUTIC OXY-PHENYL-ARYL COMPOUNDS AND THEIR USE CANCER REC TECH LTD (GB) 2012-06-20 EP disclosed