SCHEMBL2836757

SCHEMBL2836757

C(COCCC1CO1)OCCC1CO1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
TSHR P16473 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 5/20 0.39
TDP1 Q9NUW8 2/20 0.37
MAPK1 P28482 1/20 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
SCHEMBL6314526 0.97 MEN1 (0.53) MEN1KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL25182060 0.97 MEN1 (0.53) MEN1KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL1294405 0.97 MEN1 (0.53) MEN1KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL16232409 0.90 TSHR (0.62) MEN1KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL11193807 0.90 MEN1 (0.46) MEN1KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL5922768 0.88 MEN1 (0.50) MEN1KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL2831526 0.86 MEN1 (0.46) MEN1KMT2ATSHRSMN1; SMN2ALDH1A1
Di(Hydroxyethyl)Ether SCHEMBL5922763 0.85 TSHR (0.48) MEN1KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL3623720 0.85
SCHEMBL25316762 0.85

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-20100160555-A1 RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2133380-A1 RESIN COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed