SCHEMBL16008963

SCHEMBL16008963

CCOC(CO)C(OCC)C(CO)OCCO

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.35
MGAM O43451 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL8208058 0.89 ALDH1A1 (0.42) ALDH1A1LMNAMGAMTHRB
SCHEMBL6245770 0.88 LMNA (0.37) ALDH1A1LMNA
SCHEMBL1735364 0.77 TRPV1 (0.34) ALDH1A1
SCHEMBL1482928 0.72
SCHEMBL6036788 0.71 TSHR (0.50) ALDH1A1LMNAMGAMTHRB
SCHEMBL14413619 0.71 TSHR (0.39) ALDH1A1LMNAMGAM
SCHEMBL10383982 0.71 TSHR (0.34) ALDH1A1THRB
SCHEMBL6229989 0.71 TSHR (0.41) ALDH1A1MGAMTHRB
SCHEMBL13497198 0.70 TDP1 (0.36) ALDH1A1
SCHEMBL11208111 0.70 TDP1 (0.36) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9198431-B2 Use of N6-(2-hydroxyethyl)-adenosine in preparation of crop pesticide ZHEJIANG SUBTROPICAL CROPS RESEARCH INSTITUTE (CN) 2015-12-01 US claimed
US-20140256669-A1 USE OF N6-(2-HYDROXYETHYL)-ADENOSINE IN PREPARATION OF CROP PESTICIDE ZHEJIANG SUBTROPICAL CROPS RESEARCH INSTITUTE (CN) 2014-09-11 US claimed
US-9198431-B2 Use of N6-(2-hydroxyethyl)-adenosine in preparation of crop pesticide ZHEJIANG SUBTROPICAL CROPS RESEARCH INSTITUTE (CN) 2015-12-01 US disclosed
US-9198431-B2 Use of N6-(2-hydroxyethyl)-adenosine in preparation of crop pesticide ZHEJIANG SUBTROPICAL CROPS RESEARCH INSTITUTE (CN) 2015-12-01 US disclosed
US-20140256669-A1 USE OF N6-(2-HYDROXYETHYL)-ADENOSINE IN PREPARATION OF CROP PESTICIDE ZHEJIANG SUBTROPICAL CROPS RESEARCH INSTITUTE (CN) 2014-09-11 US disclosed
US-20140256669-A1 USE OF N6-(2-HYDROXYETHYL)-ADENOSINE IN PREPARATION OF CROP PESTICIDE ZHEJIANG SUBTROPICAL CROPS RESEARCH INSTITUTE (CN) 2014-09-11 US disclosed