SCHEMBL6544640

SCHEMBL6544640

CCCOC(O)COCCOCCO

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
HTT P42858 2/20 0.45
THRB P10828 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 2/20 0.45
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
USP2 O75604 2/20 0.40
MAPK1 P28482 2/20 0.40
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
CASP1 P29466 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SLCO1B3 Q9NPD5 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32
LPAR5 Q9H1C0 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
SCHEMBL11436404 1.00 MEN1 (0.45) MEN1KMT2AHTTTHRBMAPT
SCHEMBL6525043 1.00 MEN1 (0.45) MEN1KMT2AHTTTHRBMAPT
SCHEMBL6545478 1.00 MEN1 (0.45) MEN1KMT2AHTTTHRBMAPT
SCHEMBL11439282 0.96 HSD17B10 (0.46) MEN1KMT2AHTTTHRBMAPT
SCHEMBL1575700 0.89 TSHR (0.57) MEN1KMT2AHTTTHRBMAPT
SCHEMBL212883 0.89 TSHR (0.57) MEN1KMT2AHTTTHRBMAPT
SCHEMBL11436017 0.89 TSHR (0.57) MEN1KMT2AHTTTHRBMAPT
SCHEMBL6544683 0.89 TSHR (0.57) MEN1KMT2AHTTTHRBMAPT
Propylene Glycol SCHEMBL11459408 0.88 HSD17B10 (0.43) MEN1KMT2AHTTTHRBMAPT
SCHEMBL8008323 0.87 MEN1 (0.52) MEN1KMT2AHTTTHRBMAPT

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-20040014898-A1 Water-absorptive contact lens and method of producing the same MENICON CO., LTD. (JP) 2004-01-22 US disclosed
EP-1378769-A2 Water-absorptive contact lens and method of producing the same Menicon Co., Ltd. (JP) 2004-01-07 EP disclosed
US-6025449-A NEUTRALIZED; ALKYLENE OXIDE GROUP-CONTAINING (METH)ACRYLATE MONOMER; WATERPROOFING; BONDING STRENGTH KANSAI PAINT CO., LTD. (JP) 2000-02-15 US disclosed
US-4194066-A POLYMERIZING POLYOXYALKYLENE GLYCOL (METH)ACRYLATES JAPAN ATOMIC ENERGY RESEARCH INSTITUTE (JP) 1980-03-18 US disclosed