SCHEMBL7932306

SCHEMBL7932306

CCCCCC(=O)CCN1CCSCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CES2 O00748 4/20 0.38
CES1 P23141 4/20 0.38
HAO1 Q9UJM8 1/20 0.37
HRH2 P25021 2/20 0.37
HRH1 P35367 2/20 0.37
AKR1B1 P15121 1/20 0.36
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
GNAI3 P08754 3/20 0.36
GNAI1 P63096 3/20 0.36
GNAO1 P09471 2/20 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
SCHEMBL7983151 0.79 HRH2 (0.51) MAPTKMT2AALDH1A1POLBL3MBTL1
SCHEMBL8524267 0.79 THRB (0.53) MAPTKMT2AALDH1A1THRATHRB
Water SCHEMBL27813121 0.78 THRB (0.52) MAPTKMT2AALDH1A1THRATHRB
SCHEMBL968058 0.77 GNAO1 (0.52) TLR8TLR7GNAI3GNAI1GNAO1
SCHEMBL10584652 0.75 GNAO1 (0.55) GNAI3GNAI1GNAO1
SCHEMBL22222479 0.75 GNAO1 (0.55) GNAI3GNAI1GNAO1
SCHEMBL8429693 0.75 GNAO1 (0.55) GNAI3GNAI1GNAO1
SCHEMBL15921159 0.75 GNAO1 (0.55) GNAI3GNAI1GNAO1
SCHEMBL17526500 0.75 GNAO1 (0.55) GNAI3GNAI1GNAO1
SCHEMBL8431187 0.75 GNAO1 (0.55) GNAI3GNAI1GNAO1

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-6228878-B1 ADMINISTERING INDOLIN-5-ONE DERIVATIVES; INHIBITING FORMATION OF ABNORMALLY PHOSPHORYLATED PAIRED HELICAL FILAMENT EPITOPES MOLECULAR GERIATRICS CORPORATION 2001-05-08 US disclosed
US-5968936-A ADMINISTERING SUBSTITUTED 4,5,6,7-TETRAHYDRO-5-MORPHOLINOMETHYL-4-OXOINDOLES MOLECUALR GERIATRICS CORPORATION (US) 1999-10-19 US disclosed
US-5705501-A ADMINISTERING TO INHIBIT FORMATION OF ABNORMAL PHOSPHORYLATED PAIRED HELICAL FILAMENT EPITOPES MOLECULAR GERIATRICS CORPORATION (US) 1998-01-06 US disclosed