SCHEMBL4643897

SCHEMBL4643897

COC(=O)/C=C\C(=O)OCCCC(=O)Oc1cc(O)cc(O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
ATM Q13315 1/20 0.39
BACE1 P56817 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALOX5 P09917 1/20 0.36
HSP90AB1 P08238 1/20 0.36
MET P08581 2/20 0.36
AKR1B10 O60218 2/20 0.36
AKR1B1 P15121 2/20 0.36
APP P05067 2/20 0.36
HCAR2 Q8TDS4 3/20 0.36
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35

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
SCHEMBL4644748 1.00 MAPT (0.41) MAPTKMT2AMEN1ATMBACE1
SCHEMBL4642242 0.89 ATM (0.42) MAPTKMT2AMEN1ATMLMNA
SCHEMBL4642939 0.89 ATM (0.42) MAPTKMT2AMEN1ATMLMNA
SCHEMBL4642168 0.87 CYP3A4 (0.44) AKR1B10AKR1B1CA12CA1CA7
SCHEMBL4644842 0.87 CYP3A4 (0.44) AKR1B10AKR1B1CA12CA1CA7
SCHEMBL4641969 0.86 LMNA (0.47) MAPTKMT2AATMALDH1A1LMNA
SCHEMBL4641955 0.86 LMNA (0.47) MAPTKMT2AATMALDH1A1LMNA
SCHEMBL4644861 0.86 LMNA (0.47) MAPTKMT2AATMALDH1A1LMNA
SCHEMBL4646044 0.83 MAPT (0.44) MAPTKMT2AMEN1BACE1ALDH1A1
SCHEMBL4642362 0.83 MAPT (0.44) MAPTKMT2AMEN1BACE1ALDH1A1

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