SCHEMBL736276

SCHEMBL736276

CCCCCCCCC#CC(O)CCCCCCCO

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.53
LMNA P02545 4/20 0.48
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.44
CYP2D6 P10635 2/20 0.39
SPHK1 Q9NYA1 1/20 0.39
GMNN O75496 1/20 0.39
POLB P06746 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL6137599 0.94 HMGCR (0.46) HMGCRLMNAALDH1A1HSD17B10MEN1
SCHEMBL6361700 0.94 HMGCR (0.46) HMGCRLMNAALDH1A1HSD17B10MEN1
SCHEMBL6137606 0.94 HMGCR (0.46) HMGCRLMNAALDH1A1HSD17B10MEN1
SCHEMBL9626686 0.92 HMGCR (0.58) HMGCRLMNASPHK1
SCHEMBL28506401 0.91 LMNA (0.44) HMGCRLMNAALDH1A1HSD17B10MEN1
SCHEMBL6125719 0.86 HMGCR (0.51) HMGCRLMNACYP2D6SPHK1GMNN
SCHEMBL6137642 0.84 HMGCR (0.51) HMGCRLMNASPHK1
SCHEMBL6137648 0.84 HMGCR (0.51) HMGCRLMNASPHK1
Acetic Acid SCHEMBL10540684 0.84 HMGCR (0.63) HMGCR
SCHEMBL28707678 0.82 HMGCR (0.45) HMGCRLMNA

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-8137818-B2 Poly(lactic acid)-containing compositions for use in imparting oil, grease, or water resistance to paper TATE & LYLE INGREDIENTS AMERICAS LLC (US) 2012-03-20 US disclosed
US-20100021751-A1 Poly(Lactic Acid)-Containing Compositions for Use in Imparting Oil, Grease, or Water Resistance to Paper TATE & LYLE INGREDIENTS AMERICAS LLC 2010-01-28 US disclosed