SCHEMBL4644489

SCHEMBL4644489

[CH2]CCCC(=O)Oc1c(Cl)cc(Br)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
KMT2A Q03164 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
NMT1 P30419 1/20 0.33
KDM4E B2RXH2 3/20 0.33
HSP90AA1 P07900 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
MAPT P10636 1/20 0.31
ALDH1A1 P00352 2/20 0.30
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL4644082 0.92 KDM4E (0.36) POLBKMT2ATDP1NMT1KDM4E
SCHEMBL4642410 0.90 POLB (0.36) POLBKMT2ANMT1KDM4EMEN1
SCHEMBL4643664 0.87 MAPT (0.38) KMT2ATDP1KDM4EMEN1CYP3A4
SCHEMBL4644580 0.85 VCAM1 (0.41) POLBKMT2ATDP1NMT1KDM4E
SCHEMBL4642019 0.85 POLB (0.38) POLBKMT2ATDP1KDM4EMEN1
SCHEMBL4644113 0.84 POLB (0.37) POLBKMT2ATDP1KDM4EMEN1
SCHEMBL27619991 0.84 POLB (0.35) POLBKMT2ATDP1NMT1KDM4E
SCHEMBL4647539 0.84 VCAM1 (0.42) POLBKMT2ATDP1NMT1KDM4E
SCHEMBL4644190 0.83 HSD17B10 (0.38) KMT2ATDP1KDM4EMEN1CYP3A4
SCHEMBL4644365 0.83 POLB (0.38) POLBKMT2ANMT1KDM4EMEN1

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