Dodecanoate

Dodecanoate

SCHEMBL7055876

C/C(=C/C(=O)O)C(=O)O.CCCCCCCCCCCC(=O)O.CCCC[Sn]CCCC

nearest known ligand 0.52

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.52
PPARD Q03181 8/20 0.52
PPARA Q07869 8/20 0.52
GPR84 Q9NQS5 7/20 0.52
HDAC11 Q96DB2 5/20 0.52
TSHR P16473 4/20 0.52
PTPN1 P18031 4/20 0.52
FABP4 P15090 4/20 0.52
HSD17B10 Q99714 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
ALOX15 P16050 2/20 0.52
KMT2A Q03164 2/20 0.52
FABP5 Q01469 2/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
MEN1 O00255 1/20 0.52
ESR1 P03372 1/20 0.52
PDE4A P27815 1/20 0.52

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
Dodecanoate SCHEMBL7055880 1.00 PPARG (0.52) PPARGPPARDPPARAGPR84HDAC11
SCHEMBL1433848 0.89 PPARD (0.39) PPARGPPARDPPARAGPR84HDAC11
SCHEMBL1255096 0.89 PPARD (0.33) PPARGPPARDPPARAGPR84HDAC11
Dodecanoate SCHEMBL4651089 0.84 GPR84 (0.68) PPARGPPARDPPARAGPR84HDAC11
Behenic Acid SCHEMBL28815258 0.83 GPR84 (0.74) PPARGPPARDPPARAGPR84HDAC11
Dodecanoate SCHEMBL28605111 0.83 GPR84 (0.74) PPARGPPARDPPARAGPR84HDAC11
Dodecanoate SCHEMBL8984869 0.83 GPR84 (0.74) PPARGPPARDPPARAGPR84HDAC11
Stearic Acid SCHEMBL4110361 0.83 GPR84 (0.74) PPARGPPARDPPARAGPR84HDAC11
Octanoic Acid SCHEMBL3277665 0.83 GPR84 (0.74) PPARGPPARDPPARAGPR84HDAC11
Dodecanoate SCHEMBL9403716 0.83 GPR84 (0.74) PPARGPPARDPPARAGPR84HDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891993-B1 Unsaturated copolymers, processes for preparing the same, and compositions containing the same MITSUI CHEMICALS INC (JP) 2003-05-02 EP disclosed
US-6310164-B1 CONJUGATED DIENE-ALPHA-OLEFIN COPOLYMER FOR WEATHERPROOF POLYMERS MITSU CHEMICALS INC (JP) 2001-10-30 US disclosed
EP-0893245-A1 VULCANIZED MOLDING HAVING SURFACE DECORATIVE LAYER, PAINTED THERMOPLASTIC RESIN COMPOSITION, AND PAINTED ELASTOMER COMPOSITION Mitsui Chemicals, Inc. (JP) 1999-01-27 EP disclosed
EP-0891993-A1 Unsaturated copolymers, processes for preparing the same, and compositions containing the same Mitsui Chemicals, Inc. (JP) 1999-01-20 EP disclosed
EP-0234385-B1 RADIATION IMAGE STORAGE PANEL FUJI PHOTO FILM CO., LTD. (JP) 1991-09-11 EP disclosed
US-4900641-A Radiographic intensifying screen FUJI PHOTO FILM CO., LTD. (JP) 1990-02-13 US disclosed
EP-0234385-A1 Radiation image storage panel FUJI PHOTO FILM CO., LTD. (JP) 1987-09-02 EP disclosed
US-4402887-A CALENDERING WITH PLASTICIZER, PHOTOSENSITIZER, STABILIZERS, AND POLYMERIZATION INHIBITOR, THEN IRRADIATING WITH ULTRAUIOLET RADIATION DAINIPPON INK AND CHEMICALS INC. (JP) 1983-09-06 US disclosed
US-4286958-A AFTER MODIFICATION OF FIBERS WITH A BENZENESULFONYL CHLORIDE TOPPAN PRINTING CO., LTD. (JP) 1981-09-01 US disclosed