SCHEMBL4642401

SCHEMBL4642401

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
TOP2A P11388 1/20 0.33
NMT1 P30419 1/20 0.32
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 2/20 0.32
TSHR P16473 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
HIF1A Q16665 1/20 0.31
GPR35 Q9HC97 1/20 0.31
GAA P10253 1/20 0.31
RECQL P46063 1/20 0.31
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
PLAU P00749 1/20 0.30
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
GSK3B P49841 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
SCHEMBL4644450 0.92 HSD17B10 (0.36) POLBTOP2AALDH1A1KDM4EMEN1
SCHEMBL4642019 0.90 POLB (0.38) POLBALDH1A1KDM4ETSHRMEN1
SCHEMBL4644113 0.88 POLB (0.37) POLBALDH1A1KDM4ETSHRMEN1
SCHEMBL4641988 0.86 VCAM1 (0.38) POLBNMT1ALDH1A1KDM4ETSHR
SCHEMBL4644000 0.85 POLB (0.38) POLBNMT1ALDH1A1KDM4ETSHR
SCHEMBL4642147 0.85 CA1 (0.37) TOP2AALDH1A1KDM4ETSHRMEN1
SCHEMBL4642410 0.84 POLB (0.36) POLBNMT1ALDH1A1KDM4ETSHR
SCHEMBL4645094 0.84 HSD17B10 (0.40) TOP2ATSHRTHRATHRBGSK3B
SCHEMBL4644580 0.83 VCAM1 (0.41) POLBNMT1ALDH1A1KDM4EKMT2A
SCHEMBL4643853 0.82 KDM4E (0.39) POLBALDH1A1KDM4EMEN1KMT2A

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