SCHEMBL8814299

SCHEMBL8814299

CCCCCOCCCCCCOCO

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.70
MEN1 O00255 2/20 0.70
KMT2A Q03164 2/20 0.70
THRB P10828 1/20 0.70
MAPT P10636 1/20 0.70
TSHR P16473 2/20 0.56
USP2 O75604 1/20 0.54
CES2 O00748 2/20 0.52
CES1 P23141 1/20 0.47
LMNA P02545 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.43
LPAR1 Q92633 1/20 0.43
LPAR3 Q9UBY5 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
SCHEMBL8813133 1.00 HTT (0.70) HTTMEN1KMT2ATHRBMAPT
SCHEMBL7781141 0.97 HTT (0.65) HTTMEN1KMT2ATHRBMAPT
SCHEMBL379521 0.97
SCHEMBL13500392 0.97 HTT (0.65) HTTMEN1KMT2ATHRBMAPT
SCHEMBL23038721 0.97 HTT (0.65) HTTMEN1KMT2ATHRBMAPT
SCHEMBL24407352 0.97 HTT (0.65) HTTMEN1KMT2ATHRBMAPT
SCHEMBL7851734 0.97 HTT (0.65) HTTMEN1KMT2ATHRBMAPT
SCHEMBL7635768 0.97 HTT (0.65) HTTMEN1KMT2ATHRBMAPT
SCHEMBL4314388 0.97 HTT (0.65) HTTMEN1KMT2ATHRBMAPT
SCHEMBL13205146 0.97 HTT (0.65) HTTMEN1KMT2ATHRBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691319-A ANTICARCINOGENIC AGENTS SANKYO COMPANY, LIMITED (JP) 1997-11-25 US disclosed
EP-0536936-B1 Pyrimidine nucleoside derivatives having anti-tumor activity, their preparation and use SANKYO CO (JP) 1996-08-14 EP disclosed
EP-0536936-A1 Pyrimidine nucleoside derivatives having anti-tumor activity, their preparation and use Sankyo Company Limited (JP) 1993-04-14 EP disclosed