SCHEMBL4642291

SCHEMBL4642291

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 4/20 0.35
POLB P06746 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
THRA P10827 2/20 0.33
THRB P10828 2/20 0.33
ESR1 P03372 1/20 0.33
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
NR3C2 P08235 1/20 0.33
AR P10275 1/20 0.33
NMT1 P30419 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 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
SCHEMBL4642410 0.92 POLB (0.36) KDM4EPOLBMEN1KMT2ANMT1
SCHEMBL4644082 0.91 KDM4E (0.36) HSD17B10KDM4EPOLBMEN1KMT2A
SCHEMBL4647871 0.89 HSD17B10 (0.40) HSD17B10MEN1KMT2ACYP3A4THRA
SCHEMBL4643495 0.87 HSD17B10 (0.37) HSD17B10KDM4EPOLBMEN1KMT2A
SCHEMBL4644450 0.86 HSD17B10 (0.36) HSD17B10KDM4EPOLBMEN1KMT2A
SCHEMBL4646986 0.86 VCAM1 (0.36) HSD17B10KDM4EPOLBMEN1KMT2A
SCHEMBL4643853 0.83 KDM4E (0.39) HSD17B10KDM4EPOLBMEN1KMT2A
SCHEMBL4645070 0.83 VCAM1 (0.39) HSD17B10KDM4EPOLBMEN1KMT2A
SCHEMBL4644489 0.83 POLB (0.35) KDM4EPOLBMEN1KMT2ACYP1A2
SCHEMBL4641402 0.82 HSD17B10 (0.38) HSD17B10KDM4EPOLBMEN1KMT2A

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