SCHEMBL4647539

SCHEMBL4647539

O=C(CCCCO)Oc1c(Cl)cc(Br)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 4/20 0.42
POLB P06746 1/20 0.35
KDM4E B2RXH2 3/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 3/20 0.32
RECQL P46063 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
MAPT P10636 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
TP53 P04637 1/20 0.30
MAPK1 P28482 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 1/20 0.30
NMT1 P30419 1/20 0.30

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
SCHEMBL4644580 0.95 VCAM1 (0.41) VCAM1POLBKDM4EKMT2AALDH1A1
SCHEMBL4642068 0.92 VCAM1 (0.40) VCAM1POLBKDM4EKMT2AALDH1A1
SCHEMBL4641988 0.88 VCAM1 (0.38) VCAM1POLBKDM4EKMT2AALDH1A1
SCHEMBL4645070 0.88 VCAM1 (0.39) VCAM1POLBKDM4EKMT2AALDH1A1
SCHEMBL4644113 0.87 POLB (0.37) VCAM1POLBKDM4EKMT2AALDH1A1
SCHEMBL4644419 0.87 VCAM1 (0.44) VCAM1KDM4EKMT2AALDH1A1TDP1
SCHEMBL4642019 0.85 POLB (0.38) POLBKDM4EKMT2AALDH1A1RECQL
SCHEMBL4644489 0.84 POLB (0.35) POLBKDM4EKMT2AALDH1A1TDP1
SCHEMBL27619991 0.84 POLB (0.35) VCAM1POLBKDM4EKMT2AALDH1A1
SCHEMBL27619980 0.83 VCAM1 (0.44) VCAM1KDM4EKMT2ARECQLGPR84

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN 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