SCHEMBL8602013

SCHEMBL8602013

CCOC(=O)C(NS(=O)(=O)CC(C)c1ccccc1)Oc1cccc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
SLC6A2 P23975 3/20 0.41
SLC6A4 P31645 3/20 0.41
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPT P10636 1/20 0.38
RORA P35398 1/20 0.38
NR5A1 Q13285 1/20 0.38
TSHR P16473 1/20 0.37
PSMB5 P28074 1/20 0.37
MMP8 P22894 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
CNR2 P34972 1/20 0.36
OGG1 O15527 1/20 0.36

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
SCHEMBL8603619 0.93 SLC6A2 (0.43) KMT2ASLC6A2SLC6A4ALDH1A1HPGD
SCHEMBL8604551 0.82 KDM4E (0.42) KMT2AALDH1A1HPGDKDM4EMAPT
SCHEMBL8603717 0.77 BTN3A1 (0.39) SLC6A2SLC6A4ALDH1A1HPGDKDM4E
SCHEMBL8601739 0.77 HTT (0.46) KMT2AALDH1A1HPGDMAPT
SCHEMBL8602010 0.76 SLC6A4 (0.46) KMT2ASLC6A2SLC6A4ALDH1A1HPGD
SCHEMBL8602015 0.73 ALDH1A1 (0.45) KMT2ASLC6A2SLC6A4ALDH1A1HPGD
SCHEMBL10390030 0.71 TSHR (0.51) KMT2AALDH1A1HPGDKDM4ETSHR
SCHEMBL10389728 0.71 PPARG (0.49) SLC6A2SLC6A4ALDH1A1HPGDKDM4E
SCHEMBL8603456 0.69 LMNA (0.37) KMT2ASLC6A2SLC6A4ALDH1A1HPGD
SCHEMBL6707311 0.67 TSHR (0.47) KMT2AALDH1A1HPGDKDM4ETSHR

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-5723493-A PROSTAGLANDIN DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1998-03-03 US disclosed