SCHEMBL4642302

SCHEMBL4642302

O=C(CO)C(=O)C(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
CTSD P07339 1/20 0.45
CES2 O00748 2/20 0.45
CES1 P23141 2/20 0.45
HSD11B1 P28845 1/20 0.43
CYP2D6 P10635 1/20 0.43
SRC P12931 1/20 0.43

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
SCHEMBL4646786 0.83 TDP1 (0.45) POLBTDP1L3MBTL1HDAC3HDAC4
SCHEMBL4641484 0.81 TDP1 (0.47) POLBTDP1L3MBTL1HDAC3HDAC4
SCHEMBL4643576 0.80 TDP1 (0.42) POLBTDP1L3MBTL1HDAC3HDAC4
SCHEMBL9384334 0.79 CES1 (0.68) TDP1L3MBTL1HDAC3HDAC4HDAC1
SCHEMBL4647061 0.79 CES2 (0.42) POLBCES2CES1CYP2D6SRC
SCHEMBL4644116 0.79 CES2 (0.69) POLBTDP1L3MBTL1HDAC3HDAC4
SCHEMBL4642623 0.79 TDP1 (0.41) POLBTDP1L3MBTL1HDAC3HDAC4
SCHEMBL4642177 0.78 POLB (0.44) POLBTDP1L3MBTL1HDAC3HDAC4
SCHEMBL28501172 0.78 CES2 (0.53) TDP1L3MBTL1HDAC3HDAC4HDAC1
SCHEMBL7613836 0.77 HSD11B1 (0.55) POLBTDP1L3MBTL1HDAC3HDAC4

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