SCHEMBL3676686

SCHEMBL3676686

CC1=C(C2=CCCCCC2)CCCCC1.O=C(O)OC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.38
ACMSD Q8TDX5 2/20 0.36
JAK2 O60674 1/20 0.32
JAK3 P52333 1/20 0.32
CXCR5 P32302 1/20 0.32
ATR Q13535 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
ELANE P08246 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL28414825 0.85 PSMB5 (0.36) FFAR4ACMSDJAK2JAK3ELANE
SCHEMBL9419035 0.85 PSMB5 (0.36) FFAR4ACMSDJAK2JAK3ELANE
SCHEMBL3683310 0.83 ACMSD (0.44) FFAR4ACMSDJAK2JAK3ATR
SCHEMBL3677011 0.83 ACMSD (0.44) FFAR4ACMSDJAK2JAK3ATR
SCHEMBL29211185 0.76 SMURF1 (0.32) FFAR4JAK2JAK3HDAC2
SCHEMBL10779445 0.74 ACMSD (0.42) FFAR4ACMSDJAK2JAK3CXCR5
SCHEMBL3682136 0.74 HDAC4 (0.37) ACMSDHDAC4HDAC2HDAC8HDAC6
SCHEMBL7060749 0.74 HDAC4 (0.37) ACMSDHDAC4HDAC2HDAC8HDAC6
SCHEMBL10779450 0.74 ACMSD (0.42) FFAR4ACMSDJAK2JAK3CXCR5
SCHEMBL5826246 0.73 ACMSD (0.45) FFAR4ACMSDCXCR5ATRHDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685216-B1 Composition of mineral oil and an additive mixture INNOSPEC LEUNA GMBH (DE) 2013-01-30 EP disclosed
EP-1675881-B1 ADDITIVE AS COMPONENT OF MINERAL OIL COMPOSITIONS INNOSPEC LEUNA GMBH (DE) 2010-12-08 EP disclosed
EP-1675932-B1 Compositions based on mineral oil and an additive mixture INNOSPEC LEUNA GMBH (DE) 2008-12-10 EP disclosed
EP-1247837-B1 Modified amino resins for semifinished products and molded bodies having an improved resilience AMI AGROLINZ MELAMINE INT GMBH (AT) 2008-05-14 EP disclosed
EP-1685216-A1 ADDITIVE MIXTURE AS COMPONENT OF A MINERAL OIL COMPOSITION LEUNA Polymer GmbH (DE) 2006-08-02 EP disclosed
EP-1675932-A2 ADDITIVE MIXTURE AS COMPONENT OF MINERAL OIL COMPOSITIONS LEUNA Polymer GmbH (DE) 2006-07-05 EP disclosed
EP-1675881-A1 ADDITIVE AS COMPONENT OF MINERAL OIL COMPOSITIONS LEUNA Polymer GmbH (DE) 2006-07-05 EP disclosed
WO-2005040316-A2 ADDITIVE MIXTURE AS COMPONENT OF MINERAL OIL COMPOSITIONS LEUNA POLYMER GMBH (DE) 2005-05-06 WO disclosed
WO-2005040234-A1 ADDITIVE AS COMPONENT OF MINERAL OIL COMPOSITIONS LEUNA POLYMER GMBH (DE) 2005-05-06 WO disclosed
WO-2005040315-A1 ADDITIVE MIXTURE AS COMPONENT OF A MINERAL OIL COMPOSITION LEUNA POLYMER GMBH (DE) 2005-05-06 WO disclosed
WO-2003106547-A2 FLAMEPROOFING AGENT COMPOSITIONS FOR POLYOLEFIN SEMIFINISHED PRODUCTS AND POLYOLEFIN MOLDING MATERIALS AGROLINZ MELAMIN GMBH (AT) 2003-12-24 WO disclosed
EP-1247837-A2 Modified amino resins for semifinished products and molded bodies having an improved resilience Agrolinz Melamin GmbH (AT) 2002-10-09 EP disclosed