SCHEMBL4644444

SCHEMBL4644444

[CH2]C(=O)Oc1ccc(Br)cc1C=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.58
ERN1 O75460 3/20 0.50
TSHR P16473 2/20 0.40
POLB P06746 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KMT2A Q03164 2/20 0.39
HPGD P15428 3/20 0.38
ALDH1A1 P00352 2/20 0.38
TNFRSF1A P19438 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KLF5 Q13887 1/20 0.37
CYP2A6 P11509 2/20 0.37
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
MAOB P27338 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PLA2G1B P04054 1/20 0.35

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
SCHEMBL28464660 0.83 PTGDR2 (0.55) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL2879911 0.83 PTGDR2 (0.58) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL7073688 0.82 PTGDR2 (0.54) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4646089 0.82 PTGDR2 (0.57) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4647217 0.80 PTGDR2 (0.59) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4646084 0.80 PTGDR2 (0.55) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4644287 0.80 PTGDR2 (0.55) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4641651 0.78 PTGDR2 (0.56) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4644462 0.77 PTGDR2 (0.52) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4644515 0.77 ALDH1A1 (0.57) ERN1TDP1KMT2AALDH1A1RAB9A

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