SCHEMBL4646359

SCHEMBL4646359

CCOC(=O)/C=C\C(=O)OCCC(=O)OC(=O)CBr

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.47
ALDH1A1 P00352 4/20 0.47
TRPA1 O75762 1/20 0.47
ATM Q13315 1/20 0.43
MAPT P10636 6/20 0.37
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
NPSR1 Q6W5P4 2/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 1/20 0.34
MDM2 Q00987 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL4643654 1.00 HCAR2 (0.47) HCAR2ALDH1A1TRPA1ATMMAPT
SCHEMBL4643643 1.00 HCAR2 (0.47) HCAR2ALDH1A1TRPA1ATMMAPT
SCHEMBL4644080 0.87 HCAR2 (0.43) HCAR2ALDH1A1TRPA1ATMMAPT
SCHEMBL4644239 0.87 HCAR2 (0.43) HCAR2ALDH1A1TRPA1ATMMAPT
SCHEMBL4644067 0.87 HCAR2 (0.43) HCAR2ALDH1A1TRPA1ATMMAPT
SCHEMBL4641767 0.83 ALDH1A1 (0.50) HCAR2ALDH1A1TRPA1ATMMAPT
SCHEMBL4641752 0.83 ALDH1A1 (0.50) HCAR2ALDH1A1TRPA1ATMMAPT
SCHEMBL4645089 0.83 ALDH1A1 (0.50) HCAR2ALDH1A1TRPA1ATMMAPT
SCHEMBL4641539 0.81 HCAR2 (0.44) HCAR2ALDH1A1ATMMAPTCA12
SCHEMBL4641531 0.81 HCAR2 (0.44) HCAR2ALDH1A1ATMMAPTCA12

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