SCHEMBL4644707

SCHEMBL4644707

O=Cc1cc(Br)ccc1OC(=O)CCCCl

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.56
ERN1 O75460 1/20 0.41
TSHR P16473 3/20 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
PLA2G1B P04054 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
KMT2A Q03164 3/20 0.38
TOP2A P11388 2/20 0.38
HPGD P15428 3/20 0.37
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL4644906 0.96 PTGDR2 (0.55) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4643981 0.92 PTGDR2 (0.55) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4644974 0.87 PTGDR2 (0.54) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4644462 0.86 PTGDR2 (0.52) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4642317 0.86 PTGDR2 (0.52) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4641651 0.84 PTGDR2 (0.56) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4644287 0.83 PTGDR2 (0.55) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4647217 0.81 PTGDR2 (0.59) PTGDR2ERN1TSHRPOLBCTDSP1
SCHEMBL4642152 0.81 ALDH1A1 (0.53) PTGDR2POLBTDP1L3MBTL1KMT2A
SCHEMBL4646089 0.80 PTGDR2 (0.57) PTGDR2ERN1TSHRPOLBCTDSP1

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