SCHEMBL4645133

SCHEMBL4645133

[CH2]C(=O)Oc1ccc(Br)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.47
MAPT P10636 4/20 0.45
LMNA P02545 2/20 0.45
RAB9A P51151 2/20 0.45
MEN1 O00255 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
CHRNA7 P36544 2/20 0.45
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
MGLL Q99685 1/20 0.42
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.39
NCEH1 Q6PIU2 1/20 0.39
RXRA P19793 1/20 0.39

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
SCHEMBL57101 0.80 MEN1 (0.50) LDHAMAPTLMNARAB9AMEN1
SCHEMBL3504737 0.78 LDHA (0.54) LDHAMAPTLMNARAB9AMEN1
SCHEMBL9671509 0.78 LDHA (0.48) LDHAMAPTLMNARAB9AMEN1
SCHEMBL4642016 0.78 PARP10 (0.48) MAPTLMNARAB9AMEN1KMT2A
SCHEMBL26622185 0.77 LDHA (0.44) LDHAMAPTLMNARAB9AMEN1
SCHEMBL1215248 0.77 THRB (0.55) LDHAMAPTLMNARAB9AMEN1
SCHEMBL1268683 0.76 LDHA (0.47) LDHAMAPTLMNARAB9AMEN1
SCHEMBL4390857 0.76 LMNA (0.64) LMNARAB9AKMT2ARXFP1CHRNA7
SCHEMBL19675452 0.76 LDHA (0.47) LDHAMAPTLMNARAB9AMEN1
SCHEMBL2003787 0.76 CA1 (0.56) MAPTLMNARAB9ACES2CES1

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