SCHEMBL3683310

SCHEMBL3683310

C1=C(C2=CCCCCC2)CCCCC1.O=C(O)OC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.44
HDAC2 Q92769 4/20 0.38
HDAC4 P56524 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ELANE P08246 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
TYMP P19971 1/20 0.35
HDAC1 Q13547 3/20 0.35
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
HDAC3 O15379 2/20 0.34
ATR Q13535 1/20 0.33
CLCN2 P51788 1/20 0.33
JAK2 O60674 1/20 0.32
JAK3 P52333 1/20 0.32
GRM2 Q14416 1/20 0.32
GSTP1 P09211 1/20 0.32

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
SCHEMBL3677011 1.00 ACMSD (0.44) ACMSDHDAC2HDAC4HDAC8HDAC6
Bicarbonate SCHEMBL10441915 0.87 ACMSD (0.49) ACMSDHDAC2HDAC4HDAC8HDAC6
Bicarbonate SCHEMBL10962051 0.87 ACMSD (0.49) ACMSDHDAC2HDAC4HDAC8HDAC6
Bicarbonate SCHEMBL2907611 0.87 ACMSD (0.49) ACMSDHDAC2HDAC4HDAC8HDAC6
SCHEMBL10779450 0.86 ACMSD (0.42) ACMSDHDAC2HDAC4HDAC8HDAC6
SCHEMBL10779445 0.86 ACMSD (0.42) ACMSDHDAC2HDAC4HDAC8HDAC6
SCHEMBL3676686 0.83 FFAR4 (0.38) ACMSDHDAC2HDAC4HDAC8HDAC6
SCHEMBL10752335 0.80 ACMSD (0.43) ACMSDHDAC2HDAC4HDAC8HDAC6
Bicarbonate SCHEMBL10907784 0.79 ACMSD (0.44) ACMSDHDAC2HDAC4HDAC8HDAC6
SCHEMBL11201526 0.79 TYMP (0.41) ACMSDHDAC2HDAC4HDAC8HDAC6

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
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-1675881-A1 ADDITIVE AS COMPONENT OF MINERAL OIL COMPOSITIONS LEUNA Polymer GmbH (DE) 2006-07-05 EP disclosed
WO-2005040234-A1 ADDITIVE AS COMPONENT OF MINERAL OIL COMPOSITIONS LEUNA POLYMER GMBH (DE) 2005-05-06 WO disclosed
EP-0964011-B1 Polyolefine graft copolymers BOREALIS GMBH (AT) 2004-01-07 EP 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
EP-0964011-A1 Polyolefine graft copolymers Borealis AG (AT) 1999-12-15 EP disclosed
EP-0891989-A1 Modified polymers containing methylene groups PCD Polymere AG (AT) 1999-01-20 EP disclosed