SCHEMBL4644528

SCHEMBL4644528

COc1cccc(C=O)c1OC(=O)CCl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.55
TLR2 O60603 1/20 0.51
ERN1 O75460 1/20 0.51
TLR1 Q15399 1/20 0.51
TLR6 Q9Y2C9 1/20 0.51
NFE2L2 Q16236 4/20 0.48
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
POLB P06746 2/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
LMNA P02545 2/20 0.43
HPGD P15428 2/20 0.43
TOP2A P11388 1/20 0.42

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
SCHEMBL4642700 0.89 SRC (0.52) SRCTLR2ERN1TLR1TLR6
SCHEMBL4645165 0.87 SRC (0.56) SRCTLR2ERN1TLR1TLR6
SCHEMBL4647655 0.86 SRC (0.50) SRCTLR2ERN1TLR1TLR6
SCHEMBL4641996 0.86 ALDH1A1 (0.49) SRCTLR2ERN1TLR1TLR6
SCHEMBL4642150 0.85 SRC (0.55) SRCTLR2ERN1TLR1TLR6
SCHEMBL4643766 0.85 SRC (0.49) SRCTLR2ERN1TLR1TLR6
SCHEMBL4645202 0.84 SRC (0.54) SRCTLR2ERN1TLR1TLR6
SCHEMBL4644877 0.83 SRC (0.52) SRCTLR2ERN1TLR1TLR6
SCHEMBL16112334 0.83 SRC (0.62) SRCTLR2ERN1TLR1TLR6
SCHEMBL4643882 0.82 SRC (0.51) 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