SCHEMBL4645137

SCHEMBL4645137

CCOC(=O)C=CC(=O)OC(CC)C(=O)Oc1ccc(Br)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.40
MAPT P10636 10/20 0.40
ALDH1A1 P00352 4/20 0.40
LMNA P02545 6/20 0.40
NPSR1 Q6W5P4 2/20 0.40
MEN1 O00255 1/20 0.40
S1PR4 O95977 1/20 0.40
S1PR1 P21453 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
MDM2 Q00987 2/20 0.39
THRB P10828 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CYP1A2 P05177 1/20 0.37

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
SCHEMBL4645123 1.00 MAOB (0.40) MAOBMAPTALDH1A1LMNANPSR1
SCHEMBL4645667 1.00 MAOB (0.40) MAOBMAPTALDH1A1LMNANPSR1
SCHEMBL4644149 0.90 MMP1 (0.39) MAOBMAPTALDH1A1LMNANPSR1
SCHEMBL4644137 0.90 MMP1 (0.39) MAOBMAPTALDH1A1LMNANPSR1
SCHEMBL4646386 0.90 MMP1 (0.39) MAOBMAPTALDH1A1LMNANPSR1
SCHEMBL4644363 0.88 CA12 (0.51) MAOBMAPTALDH1A1LMNAMDM2
SCHEMBL4643307 0.88 TDP1 (0.44) MAOBMAPTALDH1A1LMNAMEN1
SCHEMBL4643299 0.88 TDP1 (0.44) MAOBMAPTALDH1A1LMNAMEN1
SCHEMBL4644867 0.88 CA12 (0.51) MAOBMAPTALDH1A1LMNAMDM2
SCHEMBL4644375 0.88 CA12 (0.51) MAOBMAPTALDH1A1LMNAMDM2

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