SCHEMBL6447112

SCHEMBL6447112

CCCCCCCCCC(CCCC)C(CCCC)(CCCC)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.49
GPR84 Q9NQS5 7/20 0.46
FFAR1 O14842 2/20 0.46
MAPT P10636 1/20 0.44
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
CA2 P00918 1/20 0.43
HSPD1 P10809 1/20 0.42
BLM P54132 1/20 0.42
HSPE1 P61604 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
ACE2 Q9BYF1 1/20 0.42

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
SCHEMBL9771300 1.00 FDPS (0.49) FDPSGPR84FFAR1MAPTLCK
SCHEMBL9136864 1.00 FDPS (0.49) FDPSGPR84FFAR1MAPTLCK
SCHEMBL3972398 0.98 FDPS (0.47) FDPSGPR84FFAR1MAPTLCK
SCHEMBL3975874 0.98 FDPS (0.47) FDPSGPR84FFAR1MAPTLCK
SCHEMBL3969764 0.96 FDPS (0.49) FDPSGPR84FFAR1MAPTLCK
SCHEMBL3975369 0.96 FDPS (0.49) FDPSGPR84FFAR1MAPTLCK
SCHEMBL11326560 0.96 FDPS (0.49) FDPSGPR84FFAR1MAPTLCK
SCHEMBL6406877 0.94 GPR84 (0.47) FDPSGPR84FFAR1MAPTLCK
SCHEMBL138694 0.94 GPR84 (0.47) FDPSGPR84FFAR1MAPTLCK
SCHEMBL7919937 0.94 GPR84 (0.47) FDPSGPR84FFAR1MAPTLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6972111-B1 Rosin amine anti-fouling agents BAYER AKTIENGESELLSCHAFT (DE) 2005-12-06 US disclosed
US-6929685-B2 Alkylamine derivatives as antifouling agents BAYER ATIENGESELLSCHAFT (DE) 2005-08-16 US disclosed
US-20040118318-A1 Alkylamine derivatives as antifouling agents LANXESS DEUTSCHLAND GMBH (DE) 2004-06-24 US disclosed
EP-1163210-B1 ROSIN AMINE ANTI-FOULING AGENTS BAYER CHEMICALS AG (DE) 2004-02-04 EP disclosed
EP-1372390-A2 ALKYLAMINE DERIVATIVES AS ANTIFOULING AGENTS Bayer Aktiengesellschaft (DE) 2004-01-02 EP disclosed
WO-2002076928-A2 ALKYLAMINE DERIVATIVES AS ANTIFOULING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2002-10-03 WO disclosed
EP-1245558-A1 Alkylamine derivates as anti-fouling agents Bayer Aktiengesellschaft (DE) 2002-10-02 EP disclosed
EP-1163210-A1 ROSIN AMINE ANTI-FOULING AGENTS Bayer Aktiengesellschaft (DE) 2001-12-19 EP disclosed
WO-2000055117-A1 ROSIN AMINE ANTI-FOULING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2000-09-21 WO disclosed
EP-1036786-A1 Rosin amine anti-fouling agents Bayer Aktiengesellschaft (DE) 2000-09-20 EP disclosed