SCHEMBL10489648

SCHEMBL10489648

C=CCOCCCCOCC(C)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.48
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 1/20 0.42
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
USP2 O75604 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36
CA9 Q16790 1/20 0.35
HTT P42858 1/20 0.35
PLA2G2C Q5R387 1/20 0.35
CYP2D6 P10635 2/20 0.33
SLC22A1 O15245 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
HTR1A P08908 1/20 0.33

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
SCHEMBL29467780 0.94 HSD17B10 (0.47) HSD17B10CA1CA2CA7MEN1
SCHEMBL29467783 0.94 HSD17B10 (0.47) HSD17B10CA1CA2CA7MEN1
SCHEMBL29467781 0.94 HSD17B10 (0.47) HSD17B10CA1CA2CA7MEN1
SCHEMBL13943216 0.92 HSD17B10 (0.52) HSD17B10CA1CA2CA7MEN1
SCHEMBL28166513 0.88 HSD17B10 (0.50) HSD17B10MEN1KMT2ATDP1USP2
SCHEMBL32668689 0.85
SCHEMBL27352235 0.85 CA1 (0.56) HSD17B10CA1CA2CA7MEN1
SCHEMBL221149 0.85
SCHEMBL3263850 0.85
SCHEMBL475863 0.83 CA1 (0.48) HSD17B10CA1CA2CA7MEN1

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-4847332-A USING A VINYL-FUNCTIONAL ALCOHOL AS A PROPAGATOR FOR THE CATIONIC RING-OPENING POLYMERIZATION OF CYCLIC FORMALS; GRAFT AND COMB POLYMERS THE B. F. GOODRICH COMPANY (US) 1989-07-11 US disclosed
EP-0291761-A2 Terminally unsaturated macromolecular monomers of polylactones and copolymers thereof THE B.F. GOODRICH COMPANY (US) 1988-11-23 EP disclosed