SCHEMBL15965461

SCHEMBL15965461

CCOCCOCCN(CCO)CCOCCO

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
THRB P10828 2/20 0.42
HTT P42858 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 3/20 0.42
MAPK1 P28482 2/20 0.42
HSD17B10 Q99714 2/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
POLB P06746 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
HIF1A Q16665 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
SCHEMBL15965443 1.00 ALDH1A1 (0.58) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL10965160 0.98 ALDH1A1 (0.61) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL10960094 0.96 ALDH1A1 (0.64) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL21864408 0.96 ALDH1A1 (0.64) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL15965440 0.96 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL10957080 0.96 ALDH1A1 (0.64) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL10958818 0.96 ALDH1A1 (0.64) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL10957964 0.96 ALDH1A1 (0.64) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL10960806 0.96 ALDH1A1 (0.64) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL10959406 0.96 ALDH1A1 (0.64) ALDH1A1MEN1KMT2ATHRBHTT

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
US-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 US disclosed
US-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 US disclosed