SCHEMBL4647655

SCHEMBL4647655

COc1cccc(C=O)c1OC(=O)CCCCl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.50
TLR2 O60603 1/20 0.47
ERN1 O75460 1/20 0.47
TLR1 Q15399 1/20 0.47
TLR6 Q9Y2C9 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
NFE2L2 Q16236 3/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.41
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 2/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 3/20 0.40
POLB P06746 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL4643766 0.96 SRC (0.49) SRCTLR2ERN1TLR1TLR6
SCHEMBL4642700 0.92 SRC (0.52) SRCTLR2ERN1TLR1TLR6
SCHEMBL4645983 0.88 MEN1 (0.44) SRCTLR2ERN1TLR1TLR6
SCHEMBL4643882 0.88 SRC (0.51) SRCTLR2ERN1TLR1TLR6
SCHEMBL4643841 0.87 SRC (0.50) SRCTLR2ERN1TLR1TLR6
SCHEMBL4645078 0.87 SRC (0.50) SRCTLR2ERN1TLR1TLR6
SCHEMBL4644528 0.86 SRC (0.55) SRCTLR2ERN1TLR1TLR6
SCHEMBL4645202 0.85 SRC (0.54) SRCTLR2ERN1TLR1TLR6
SCHEMBL4647819 0.85 KMT2A (0.43) SRCNPC1RAB9APTGDR2ALDH1A1
SCHEMBL4644877 0.84 SRC (0.52) SRCTLR2ERN1TLR1TLR6

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