SCHEMBL6206063

SCHEMBL6206063

CCCCC1=CC(=O)C(O)=C(CCCC)C1=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 17/20 0.63
MPEG1 Q2M385 11/20 0.63
XIAP P98170 4/20 0.63
GPR84 Q9NQS5 2/20 0.63
KDM4E B2RXH2 1/20 0.63
MEN1 O00255 1/20 0.63
PTGES O14684 1/20 0.63
USP2 O75604 1/20 0.63
ALDH1A1 P00352 1/20 0.63
TP53 P04637 1/20 0.63
CYP2D6 P10635 1/20 0.63
MAPT P10636 1/20 0.63
CYP2C9 P11712 1/20 0.63
HPGD P15428 1/20 0.63
ALOX15 P16050 1/20 0.63
ALOX12 P18054 1/20 0.63
MAPK1 P28482 1/20 0.63
CYP2C19 P33261 1/20 0.63
KMT2A Q03164 1/20 0.63
KAT2B Q92831 1/20 0.63

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
SCHEMBL1020311 0.85 ALOX5 (0.49) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL6410428 0.79 ALOX5 (0.97) ALOX5MPEG1XIAPGPR84KDM4E
Embelin SCHEMBL148744 0.77 ALOX5 (1.00) ALOX5MPEG1XIAPGPR84KDM4E
Rapanone SCHEMBL2311835 0.77 ALOX5 (1.00) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL12757276 0.77 ALOX5 (1.00) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL17123718 0.76 ALOX5 (0.73) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL27186631 0.76 ALOX5 (0.42) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL28584301 0.75 ALOX5 (0.50) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL6361888 0.74 STAT3 (0.58) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL932791 0.73 ALOX5 (0.51) ALOX5MPEG1XIAPGPR84KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1292268-B1 AGENT FOR DYEING KERATIN CONTAINING FIBERS HENKEL KGAA (DE) 2005-02-23 EP claimed
EP-1292268-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2003-03-19 EP claimed
WO-2001097764-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 WO claimed
EP-1292268-B1 AGENT FOR DYEING KERATIN CONTAINING FIBERS HENKEL KGAA (DE) 2005-02-23 EP disclosed
EP-1292268-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2003-03-19 EP disclosed
WO-2001097764-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 WO disclosed