SCHEMBL4647233

SCHEMBL4647233

CCOC(=O)c1ccc(OC(C)=O)c(OC)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 1/20 0.66
TSHR P16473 4/20 0.65
RAB9A P51151 4/20 0.59
NPC1 O15118 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MAPT P10636 6/20 0.57
LMNA P02545 1/20 0.56
KMT2A Q03164 3/20 0.56
GAA P10253 2/20 0.56
PKM P14618 2/20 0.56
MEN1 O00255 2/20 0.56
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 3/20 0.53
MAPK1 P28482 1/20 0.53
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51

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
SCHEMBL30506315 0.89 HSD17B2 (0.76) HSD17B2TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL1660365 0.89 HSD17B2 (0.76) HSD17B2TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL11177279 0.87 TSHR (0.63) HSD17B2TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL431676 0.87 HSD17B2 (0.64) HSD17B2TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL4647227 0.87 HSD17B2 (0.64) HSD17B2TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL28678072 0.86 MAPT (0.59) TSHRRAB9ANPC1SMN1; SMN2MAPT
SCHEMBL4641813 0.85 HSD17B2 (0.62) HSD17B2TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL31474384 0.84 TSHR (0.71) HSD17B2TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL310621 0.84 TSHR (0.71) HSD17B2TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL28659820 0.84 CA12 (0.54) HSD17B2TSHRRAB9ANPC1SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed