SCHEMBL681091

SCHEMBL681091

CCC(C)(CC)COC(=O)C(C)(C)C(O)O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
HSD17B10 Q99714 1/20 0.37
TSHR P16473 2/20 0.32
CYP3A4 P08684 1/20 0.32
NFKB1 P19838 1/20 0.32
ADRA1A P35348 1/20 0.32
RAB9A P51151 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL235869 0.81 HTT (0.32)
SCHEMBL30096986 0.76 PRKCA (0.32)
SCHEMBL10171465 0.72 ALDH1A1 (0.48) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL20747677 0.69 GRIN2D (0.47) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL7741487 0.68
SCHEMBL15024590 0.67 ALDH1A1 (0.48) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL3095013 0.67 LMNA (0.39) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL8815751 0.67 LMNA (0.36) LMNAHSD17B10
SCHEMBL15891838 0.66 PRKCA (0.43) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL1784700 0.66 KMT2A (0.35) LMNAHSD17B10TSHRTDP1

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-20120004373-A1 POWDER COATING COMPOSITIONS CROSS-LINKED WITH NON CYANURATE POLYEPOXIDES HEXION INC. (FORMERLY KNOWN AS MOMENTIVE SPECIALTY CHEMICALS INC.) 2012-01-05 US disclosed
EP-2161294-A1 Hydroxyl polyester resins with high Tg Hexion Specialty Chemicals Research Belgium S.A. (BE) 2010-03-10 EP disclosed
EP-2098552-A1 Thermosetting polyester resin modified with semi-crystalline polyester for powder coatings Hexion Specialty Chemicals Research Belgium S.A. (BE) 2009-09-09 EP disclosed
EP-1920016-A2 IMPROVEMENTS IN AND RELATING TO POWDER COATING COMPOSITIONS CROSS-LINKED WITH NON CYANURATE POLYEPOXIDES Hexion Specialty Chemicals Research Belgium S.A. (BE) 2008-05-14 EP disclosed
WO-2007025664-A2 IMPROVEMENTS IN AND RELATING TO POWDER COATING COMPOSITIONS CROSS-LINKED WITH NON CYANURATE POLYEPOXIDES HEXION SPECIALTY CHEMICALS RESEARCH BELGIUM S.A. (BE) 2007-03-08 WO disclosed
US-6284845-B1 POWDERED COATING COMPOSITION WHICH INCLUDES A CARBOXYL TERMINATED POLYESTER, EPOXY COMPOUNDS AND AN ONIUM CATALYST OR BETA-HYDROXYALKYLAMIDE MCWHORTER TECHNOLOGIES 2001-09-04 US disclosed