SCHEMBL3819799

SCHEMBL3819799

CCCCCC(CCC)CC(CCCC(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.54
GRIK2 Q13002 2/20 0.54
SLC1A2 P43004 2/20 0.54
SLC1A1 P43005 2/20 0.54
FFAR4 Q5NUL3 2/20 0.49
FFAR1 O14842 2/20 0.49
SLC1A3 P43003 1/20 0.47
AKR1B1 P15121 1/20 0.47
CA2 P00918 1/20 0.46
MAPK1 P28482 1/20 0.46
GPR84 Q9NQS5 7/20 0.46
PPARG P37231 6/20 0.46
PPARD Q03181 6/20 0.46
PPARA Q07869 6/20 0.46
HDAC11 Q96DB2 5/20 0.46
TSHR P16473 4/20 0.46
ALDH1A1 P00352 2/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46

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
SCHEMBL3813892 0.97 GRIK1 (0.54) GRIK1GRIK2SLC1A2SLC1A1FFAR4
SCHEMBL3809955 0.95 FFAR4 (0.56) GRIK1GRIK2SLC1A2SLC1A1FFAR4
SCHEMBL3816608 0.95 FFAR4 (0.56) GRIK1GRIK2SLC1A2SLC1A1FFAR4
SCHEMBL3815346 0.95 FFAR4 (0.56) GRIK1GRIK2SLC1A2SLC1A1FFAR4
SCHEMBL3818239 0.95 FFAR4 (0.56) GRIK1GRIK2SLC1A2SLC1A1FFAR4
SCHEMBL3810653 0.95 FFAR4 (0.56) GRIK1GRIK2SLC1A2SLC1A1FFAR4
SCHEMBL2477780 0.95 GRIK1 (0.58) GRIK1GRIK2SLC1A2SLC1A1FFAR4
SCHEMBL3809808 0.92 GRIK1 (0.51) GRIK1GRIK2SLC1A2SLC1A1FFAR4
SCHEMBL3752121 0.90 FFAR4 (0.57) GRIK1GRIK2SLC1A2SLC1A1FFAR4
SCHEMBL3813153 0.90 GRIK1 (0.61) GRIK1GRIK2SLC1A2SLC1A1FFAR1

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
US-9314414-B2 Cosmetic compositions containing esters based on 2-propylheptanol COGNIS IP MANAGEMENT GMBH (DE) 2016-04-19 US disclosed
US-9314413-B2 Cosmetic compositions containing esters based on 2-propylheptanol COGNIS IP MANAGEMENT GMBH (DE) 2016-04-19 US disclosed
US-20140121286-A1 Cosmetic Compositions Containing Esters Based on 2-Propylheptanol COGNIS IP MANAGEMENT GMBH (DE) 2014-05-01 US disclosed
US-20140121394-A1 Cosmetic Compositions Containing Esters Based on 2-Propylheptanol COGNIS IP MANAGEMENT GMBH (DE) 2014-05-01 US disclosed
US-8642652-B2 Cosmetic compositions containing esters based on 2-propylheptanol COGNIS IP MANAGEMENT GMBH (DE) 2014-02-04 US disclosed
US-20090182046-A1 Cosmetic Compositions Containing Esters Based on 2-Propylheptanol COGNIS IP MANAGEMENT GMBH (DE) 2009-07-16 US disclosed