SCHEMBL4644807

SCHEMBL4644807

CC[CH]C(=O)Oc1c(Br)cc(Br)cc1C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 4/20 0.44
ALDH1A1 P00352 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 2/20 0.36
HSD17B10 Q99714 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
KMT2A Q03164 5/20 0.33
MAPT P10636 4/20 0.33
MEN1 O00255 3/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PRKDC P78527 1/20 0.33
MAPK1 P28482 1/20 0.32
HPGD P15428 1/20 0.32
THRB P10828 1/20 0.32
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
PTBP1 P26599 1/20 0.31

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
SCHEMBL4647606 0.89 ERN1 (0.41) ERN1ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL4647866 0.88 HSD17B10 (0.42) ERN1ALDH1A1LMNAHSD17B10KMT2A
SCHEMBL4644715 0.83 ERN1 (0.47) ERN1ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL4642286 0.81 HSD17B10 (0.37) ALDH1A1CYP1A2CYP2C19LMNAHSD17B10
SCHEMBL4641645 0.80 ERN1 (0.50) ERN1ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL4647388 0.77 ERN1 (0.47) ERN1ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL4644283 0.77 PTGDR2 (0.55) ERN1ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL4641640 0.76 ERN1 (0.50) ERN1ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL4641549 0.76 ERN1 (0.46) ERN1ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL4644717 0.76 ERN1 (0.46) ERN1ALDH1A1CYP1A2CYP2C19LMNA

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