SCHEMBL4644082

SCHEMBL4644082

[CH2]CCCC(=O)Oc1c(Cl)cc(Br)cc1Br

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.36
KMT2A Q03164 5/20 0.34
MEN1 O00255 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
NPY1R P25929 1/20 0.32
NPY2R P49146 1/20 0.32
THRA P10827 3/20 0.32
THRB P10828 3/20 0.32
ESR1 P03372 1/20 0.32
NR3C1 P04150 1/20 0.32
PGR P06401 1/20 0.32

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
SCHEMBL4644489 0.92 POLB (0.35) KDM4EKMT2AMEN1CYP1A2CYP2D6
SCHEMBL4642291 0.91 HSD17B10 (0.35) KDM4EKMT2AMEN1CYP1A2CYP2D6
SCHEMBL4644190 0.89 HSD17B10 (0.38) KDM4EKMT2AMEN1CYP3A4HSD17B10
SCHEMBL4645070 0.87 VCAM1 (0.39) KDM4EKMT2AMEN1CYP1A2CYP2D6
SCHEMBL4643853 0.87 KDM4E (0.39) KDM4EKMT2AMEN1CYP1A2CYP2D6
SCHEMBL4642068 0.85 VCAM1 (0.40) KDM4EKMT2AMEN1CYP1A2CYP2D6
SCHEMBL4645432 0.85 KDM4E (0.39) KDM4EKMT2AMEN1CYP1A2CYP2D6
SCHEMBL4643495 0.84 HSD17B10 (0.37) KDM4EKMT2AMEN1CYP1A2CYP2D6
SCHEMBL4646986 0.83 VCAM1 (0.36) KDM4EKMT2AMEN1CYP1A2CYP2D6
SCHEMBL4644450 0.83 HSD17B10 (0.36) KDM4EKMT2AMEN1CYP1A2CYP2D6

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