SCHEMBL4799643

SCHEMBL4799643

O=C(O)CCCCCC(CO)CCCC(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTK1 Q9Y2Q3 2/20 0.67
TSHR P16473 4/20 0.55
LMNA P02545 3/20 0.55
NFKB1 P19838 1/20 0.55
PMP22 Q01453 1/20 0.55
GPR84 Q9NQS5 4/20 0.52
FFAR1 O14842 3/20 0.52
FFAR4 Q5NUL3 3/20 0.52
ALDH1A1 P00352 3/20 0.47
ENPEP Q07075 1/20 0.45
PPARG P37231 4/20 0.44
PPARD Q03181 4/20 0.44
PPARA Q07869 4/20 0.44
HDAC11 Q96DB2 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
TLR2 O60603 1/20 0.44
MEN1 O00255 1/20 0.44
ESR1 P03372 1/20 0.44

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
SCHEMBL2181037 0.98 GSTK1 (0.63) GSTK1TSHRLMNANFKB1PMP22
SCHEMBL29234488 0.98 GSTK1 (0.63) GSTK1TSHRLMNANFKB1PMP22
SCHEMBL4796411 0.98 GSTK1 (0.63) GSTK1TSHRLMNANFKB1PMP22
SCHEMBL15264615 0.98 GSTK1 (0.63) GSTK1TSHRLMNANFKB1PMP22
SCHEMBL31015823 0.98 GSTK1 (0.63) GSTK1TSHRLMNANFKB1PMP22
SCHEMBL31109139 0.98 GSTK1 (0.63) GSTK1TSHRLMNANFKB1PMP22
SCHEMBL31015822 0.98 GSTK1 (0.63) GSTK1TSHRLMNANFKB1PMP22
SCHEMBL3596883 0.95 GSTK1 (0.61) GSTK1TSHRLMNANFKB1PMP22
SCHEMBL18605691 0.93 GSTK1 (0.63) GSTK1TSHRLMNANFKB1PMP22
SCHEMBL4802389 0.91 FFAR1 (0.67) GSTK1TSHRLMNANFKB1PMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080268511-A1 Biooxidation capabilities of Candida sp EIRICH L DUDLEY 2008-10-30 US disclosed
US-20080261283-A1 Biooxidation capabilities of Candida sp EIRICH L DUDLEY 2008-10-23 US disclosed
US-7405063-B2 Biooxidation capabilities of Candida sp COGNIS CORPORATION (US) 2008-07-29 US disclosed
US-20050181491-A1 Biooxidation capabilities of candida sp COGNIS IP MANAGEMENT GMBH (DE) 2005-08-18 US disclosed
US-20020061566-A1 Biooxidation capabilities of candida sp COGNIS CORPORATION (COGNIS CORP.) 2002-05-23 US disclosed