SCHEMBL2344544

SCHEMBL2344544

CCCCCCCCOCCCCCCCC.CCCC[Sn]CCC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
THRB P10828 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
CES2 O00748 2/20 0.42
CES1 P23141 1/20 0.42
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
USP2 O75604 1/20 0.39
TSHR P16473 2/20 0.39
SPHK1 Q9NYA1 1/20 0.35
LPAR1 Q92633 2/20 0.34
LPAR3 Q9UBY5 2/20 0.34
LPAR2 Q9HBW0 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL2344032 1.00 HTT (0.50) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2347646 1.00 HTT (0.50) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2345733 0.98 HTT (0.46) HTTTHRBMEN1KMT2AMAPT
SCHEMBL982256 0.95 HTT (0.54) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2344781 0.95 HTT (0.54) HTTTHRBMEN1KMT2AMAPT
SCHEMBL9466593 0.95 HTT (0.54) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2351301 0.95 HTT (0.54) HTTTHRBMEN1KMT2AMAPT
SCHEMBL10540819 0.95 HTT (0.54) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2341894 0.95 HTT (0.54) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2350842 0.95 HTT (0.54) HTTTHRBMEN1KMT2AMAPT

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
EP-1640357-B1 METHOD FOR PRODUCING AROMATIC CARBONATE ASAHI KASEI CHEMICALS CORP (JP) 2011-08-31 EP disclosed
US-7652122-B2 Method for producing an aromatic carbonate ASAHI KASEI CHEMICALS CORPORATION (JP) 2010-01-26 US disclosed
US-20070055042-A1 Method for producing an aromatic carbonate ASAHI KASEI KABUSHIKI KAISHA (JP) 2007-03-08 US disclosed
EP-1640357-A1 METHOD FOR PRODUCING AROMATIC CARBONATE Asahi Kasei Chemicals Corporation (JP) 2006-03-29 EP disclosed