SCHEMBL4644345

SCHEMBL4644345

C=C(C)C(=O)OCC(=O)OC(=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.45
LMNA P02545 2/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
TSHR P16473 2/20 0.42
MAPK1 P28482 1/20 0.41
HIF1A Q16665 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
F2 P00734 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 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
SCHEMBL28098371 0.84 ALDH1A1 (0.45) ELANELMNAALDH1A1TDP1TSHR
SCHEMBL28776762 0.83 RAB9A (0.50) ELANELMNAALDH1A1MAPTTDP1
SCHEMBL28514832 0.81 ELANE (0.54) ELANELMNAALDH1A1MAPTTDP1
SCHEMBL8773117 0.81 TDP1 (0.57) LMNAALDH1A1TDP1NPC1RAB9A
SCHEMBL777588 0.81 ELANE (0.54) ELANELMNAALDH1A1MAPTTDP1
SCHEMBL24501966 0.80 ELANE (0.50) ELANELMNAALDH1A1MAPTTDP1
SCHEMBL9018645 0.80 NPC1 (0.54) ELANELMNAALDH1A1MAPTTDP1
SCHEMBL3422924 0.80 ELANE (0.50) ELANELMNAALDH1A1MAPTTDP1
SCHEMBL13275229 0.80 LMNA (0.53) ELANELMNAALDH1A1TDP1NPC1
SCHEMBL3788226 0.80 ELANE (0.53) ELANELMNAALDH1A1MAPTTDP1

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 2 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
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN disclosed