SCHEMBL8536239

SCHEMBL8536239

CCCO[CH]OCCCO

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 2/20 0.38
TSHR P16473 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HSD17B10 Q99714 1/20 0.38
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL6176372 0.81 ADRB2 (0.41) ALDH1A1SMN1; SMN2LMNATSHRTHRB
SCHEMBL1937796 0.81
SCHEMBL1935530 0.75 ADRB2 (0.45) ALDH1A1SMN1; SMN2LMNATSHRTHRB
SCHEMBL6433585 0.73
1,4-Butanediol SCHEMBL1356092 0.73 SMN1; SMN2 (0.43) ALDH1A1SMN1; SMN2LMNATSHRMEN1
SCHEMBL5342 0.73
SCHEMBL6178131 0.73 THRB (0.41) TSHRMEN1KMT2ATHRBHTT
SCHEMBL6437594 0.72
SCHEMBL223572 0.70
SCHEMBL854543 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750343-A Methods of detecting nucleic acids with nucleotide probes containing 4'-substituted nucleotides and kits therefor SYNTEX INC. (US) 1998-05-12 US disclosed
US-5446137-A Substituent selected from linking group containing modifiers such as biotin, reactive groups, nucleic acids, catalysts, DNA intercalators, minor groove binders, clevage agents, and detectable labels SYNTEX (U.S.A.) INC. (US) 1995-08-29 US disclosed