SCHEMBL4645122

SCHEMBL4645122

COC(=O)C=CC(=O)OC(C)(C(=O)OC(C)=O)C(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.43
CES1 P23141 1/20 0.37
PRSS1 P07477 2/20 0.36
CTSG P08311 2/20 0.36
CTRB1 P17538 2/20 0.36
CMA1 P23946 2/20 0.36
ALDH1A1 P00352 4/20 0.36
MAPT P10636 3/20 0.36
HTT P42858 2/20 0.36
NR1H4 Q96RI1 1/20 0.36
TSHR P16473 1/20 0.36
PARP1 P09874 1/20 0.35
PARP15 Q460N3 1/20 0.35
PARP14 Q460N5 1/20 0.35
PARP10 Q53GL7 1/20 0.35
ELANE P08246 2/20 0.35
HCAR2 Q8TDS4 2/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
NPC1 O15118 2/20 0.34

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
SCHEMBL4646092 0.87 MAPT (0.39) CES1ALDH1A1MAPTELANENPC1
SCHEMBL4643871 0.86 MAPT (0.47) ALDH1A1MAPTHCAR2NPC1RAB9A
SCHEMBL6553847 0.83 ABCG2 (0.39) MAPTHTTNPC1RAB9AKDM4E
SCHEMBL4644585 0.81 SRC (0.40) SRCCES1PRSS1CTSGCTRB1
SCHEMBL4641582 0.79 SRC (0.39) SRCCES1PRSS1CTSGCTRB1
SCHEMBL4642012 0.76 MEN1 (0.41) ALDH1A1MAPTELANENPC1RAB9A
SCHEMBL4641322 0.76 HCAR2 (0.42) ALDH1A1MAPTTSHRHCAR2KEAP1
SCHEMBL4644072 0.76 HCAR2 (0.42) ALDH1A1MAPTHTTTSHRHCAR2
SCHEMBL4644127 0.73 SRC (0.38) SRCCES1PRSS1CTSGCTRB1
SCHEMBL4642731 0.70 MAPT (0.43) ALDH1A1MAPTHCAR2NPC1RAB9A

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