SCHEMBL4645086

SCHEMBL4645086

CCOC(=O)/C=C/C(=O)OC(Br)C(=O)OC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.47
ALDH1A1 P00352 4/20 0.38
LMNA P02545 4/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 8/20 0.37
TTR P02766 1/20 0.36
DPP4 P27487 1/20 0.36
ATM Q13315 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
MDM2 Q00987 2/20 0.35
MDM4 O15151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
TSHR P16473 1/20 0.33
SOAT1 P35610 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL4641749 1.00 HCAR2 (0.47) HCAR2ALDH1A1LMNAHSD17B10MAPT
SCHEMBL4645189 0.83 HCAR2 (0.46) HCAR2ALDH1A1HSD17B10MAPTTTR
SCHEMBL4641592 0.83 HCAR2 (0.46) HCAR2ALDH1A1HSD17B10MAPTTTR
SCHEMBL4641762 0.81 HCAR2 (0.44) HCAR2ALDH1A1LMNAHSD17B10MAPT
SCHEMBL4642370 0.78 HCAR2 (0.44) HCAR2ALDH1A1LMNAHSD17B10MAPT
SCHEMBL4644270 0.78 HCAR2 (0.44) HCAR2ALDH1A1LMNAHSD17B10MAPT
SCHEMBL4642382 0.75 HCAR2 (0.42) HCAR2ALDH1A1LMNAHSD17B10MAPT
SCHEMBL28004201 0.74 HCAR2 (0.52) HCAR2ALDH1A1LMNAMAPTTTR
Diethyl Maleate SCHEMBL28618621 0.73 HCAR2 (0.67) HCAR2ALDH1A1LMNAHSD17B10MAPT
SCHEMBL4645230 0.73 HCAR2 (0.40) HCAR2ALDH1A1LMNAHSD17B10MAPT

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