SCHEMBL8938880

SCHEMBL8938880

CN(C)c1ccc(C2CCc3cc(O)c(O)cc32)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.54
ALOX15 P16050 1/20 0.54
ADCY5 O95622 2/20 0.48
DRD1 P21728 8/20 0.45
SIGMAR1 Q99720 2/20 0.45
THPO P40225 2/20 0.45
HIF1A Q16665 2/20 0.45
HSD17B10 Q99714 2/20 0.45
MAPK1 P28482 2/20 0.45
MTOR P42345 1/20 0.45
KDM4E B2RXH2 4/20 0.44
MAPT P10636 3/20 0.44
DRD2 P14416 3/20 0.44
BLM P54132 2/20 0.44
PMP22 Q01453 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HPGD P15428 3/20 0.43
DRD5 P21918 2/20 0.43
ADCY6 O43306 1/20 0.43
ADCY3 O60266 1/20 0.43

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
SCHEMBL8938850 0.82 IGF1R (0.61) IGF1RALOX15ADCY5DRD1THPO
SCHEMBL29140455 0.77 KDM1A (0.72) GAA
SCHEMBL30789066 0.77 KDM1A (0.72) GAA
SCHEMBL28129775 0.76 SIGMAR1 (0.55) SIGMAR1MAPK1KDM4EALDH1A1
SCHEMBL27880552 0.73 CYP26A1 (0.39) DRD1SIGMAR1KDM4EDRD2DRD5
SCHEMBL8938866 0.72 GAA (0.43) MAPK1CYP3A4ALDH1A1GAA
SCHEMBL10335575 0.70 ALOX15 (0.71) IGF1RALOX15ADCY5DRD1THPO
SCHEMBL8085206 0.70 SLC6A2 (0.44) SIGMAR1MTORDRD2CYP3A4CYP2C9
SCHEMBL8990537 0.69 GAA (0.40) MAPK1ALDH1A1GAA
SCHEMBL13853486 0.68 DRD2 (0.53) DRD1HIF1AHSD17B10KDM4EDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5543298-A ADDING SPECIFIED COMPOUND TO LIQUID SAMPLE, MEASURING RATE OF AUTOOXIDATION SPECTROPHOTOMETRICALLY OXIS INTERNATIONAL S.A. (FR) 1996-08-06 US disclosed
EP-0625209-B1 METHOD FOR ASSAYING THE SOD ACTIVITY BY USING A SELF- OXIDIZABLE COMPOUND NECESSARY FOR ITS IMPLEMENTATION, SELF- OXIDIZABLE COMPOUNDS AND PREPARATION THEREOF OXIS INT SA (FR) 1996-07-17 EP disclosed
EP-0625209-A1 METHOD FOR ASSAYING THE SOD ACTIVITY BY USING A SELF-OXIDIZABLE COMPOUND NECESSARY FOR ITS IMPLEMENTATION, SELF-OXIDIZABLE COMPOUNDS AND PREPARATION THEREOF. BIOXYTECH (FR) 1994-11-23 EP disclosed
WO-1993011258-A1 METHOD FOR ASSAYING THE SOD ACTIVITY BY USING A SELF-OXIDIZABLE COMPOUND NECESSARY FOR ITS IMPLEMENTATION, SELF-OXIDIZABLE COMPOUNDS AND PREPARATION THEREOF BIOXYTECH (FR) 1993-06-10 WO disclosed