SCHEMBL4644283

SCHEMBL4644283

CC[CH]C(=O)Oc1ccc(Br)cc1C=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.55
ERN1 O75460 2/20 0.44
HPGD P15428 2/20 0.41
TSHR P16473 2/20 0.41
PLA2G1B P04054 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TNFRSF1A P19438 1/20 0.36
LMNA P02545 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL4644460 0.89 PTGDR2 (0.52) PTGDR2ERN1HPGDTSHRPLA2G1B
SCHEMBL4646084 0.83 PTGDR2 (0.55) PTGDR2ERN1HPGDTSHRPLA2G1B
SCHEMBL4642355 0.81 KDM4E (0.52) ERN1L3MBTL1TDP1ALDH1A1KDM4E
SCHEMBL4644728 0.81 CREBBP (0.42) PTGDR2HPGDTSHRPOLBTDP1
SCHEMBL28464660 0.80 PTGDR2 (0.55) PTGDR2ERN1HPGDTSHRL3MBTL1
SCHEMBL4647755 0.80 ALDH1A1 (0.52) PTGDR2ERN1HPGDPOLBTDP1
SCHEMBL2879911 0.80 PTGDR2 (0.58) PTGDR2ERN1HPGDTSHRL3MBTL1
SCHEMBL4647217 0.77 PTGDR2 (0.59) PTGDR2ERN1HPGDTSHRPLA2G1B
SCHEMBL4644807 0.77 ERN1 (0.44) PTGDR2ERN1HPGDPOLBTDP1
SCHEMBL4644444 0.76 PTGDR2 (0.58) PTGDR2ERN1HPGDTSHRPLA2G1B

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