SCHEMBL4644946

SCHEMBL4644946

COC(=O)/C=C/C(=O)OCC(=O)Oc1ccc(Br)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GAA P10253 2/20 0.40
MGLL Q99685 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL4643435 1.00 MAPT (0.44) MAPTALDH1A1LMNAKMT2AHTT
SCHEMBL4643443 1.00 MAPT (0.44) MAPTALDH1A1LMNAKMT2AHTT
SCHEMBL4643678 0.88 MAPT (0.49) MAPTALDH1A1LMNAKMT2AGAA
SCHEMBL4643674 0.88 MAPT (0.49) MAPTALDH1A1LMNAKMT2AGAA
SCHEMBL4644055 0.88 MAPT (0.49) MAPTALDH1A1LMNAKMT2AGAA
SCHEMBL4643506 0.88 GAA (0.53) MAPTALDH1A1LMNAKMT2AHTT
SCHEMBL4647011 0.88 GAA (0.53) MAPTALDH1A1LMNAKMT2AHTT
SCHEMBL4643498 0.88 GAA (0.53) MAPTALDH1A1LMNAKMT2AHTT
SCHEMBL4647565 0.87 CA12 (0.49) MAPTALDH1A1LMNAKMT2AHTT
SCHEMBL4644739 0.87 CA12 (0.49) MAPTALDH1A1LMNAKMT2AHTT

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