SCHEMBL28023456

SCHEMBL28023456

CCCCCCC(CCC)(OC(=O)CC)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.43
CES2 O00748 1/20 0.41
PAM P19021 2/20 0.36
GPR84 Q9NQS5 7/20 0.35
PPARG P37231 6/20 0.35
PPARD Q03181 6/20 0.35
PPARA Q07869 6/20 0.35
HDAC11 Q96DB2 5/20 0.35
TSHR P16473 4/20 0.35
ALDH1A1 P00352 2/20 0.35
TLR2 O60603 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
FABP4 P15090 2/20 0.35
PTPN1 P18031 2/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
MEN1 O00255 1/20 0.35
ESR1 P03372 1/20 0.35
ALOX15 P16050 1/20 0.35
PDE4A P27815 1/20 0.35

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
SCHEMBL28022768 0.98 NAAA (0.40) NAAACES2PAMGPR84PPARG
SCHEMBL28023360 0.88 PAM (0.46) NAAAPAMGPR84PPARGPPARD
SCHEMBL15903072 0.84 CES2 (0.42) CES2GPR84PPARGPPARDPPARA
SCHEMBL28820880 0.84 CES2 (0.42) CES2GPR84PPARGPPARDPPARA
SCHEMBL4445628 0.83 CES2 (0.44) CES2GPR84PPARGPPARDPPARA
SCHEMBL28023513 0.82 CES2 (0.39) CES2GPR84PPARGPPARDPPARA
SCHEMBL8682806 0.79 MEN1 (0.39) CES2PAMGPR84PPARGPPARD
SCHEMBL28023359 0.77 CES2 (0.42) NAAACES2TSHRTDP1MEN1
SCHEMBL28022853 0.77 NAAA (0.44) NAAACES2PAMGPR84PPARG
SCHEMBL28023338 0.77 NAAA (0.44) NAAACES2PAMGPR84PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104755510-A Ziegler-Natta catalyst systems comprising a 1,2-phenylenedioate as internal donor and process for preparing the same INDIAN OIL CORP LTD 2015-07-01 CN claimed
CN-104755510-A Ziegler-Natta catalyst systems comprising a 1,2-phenylenedioate as internal donor and process for preparing the same INDIAN OIL CORP LTD 2015-07-01 CN disclosed