SCHEMBL28023398

SCHEMBL28023398

CCC(=O)OC(CCCCCCCC(C)(C)C)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.38
ACACA Q13085 1/20 0.38
GPR84 Q9NQS5 3/20 0.33
FFAR1 O14842 2/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPT P10636 1/20 0.33
LCK P06239 1/20 0.33
PPARD Q03181 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
CPB2 Q96IY4 1/20 0.32
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32
CA2 P00918 2/20 0.32
CPT2 P23786 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
SCHEMBL28022836 1.00 ACACB (0.38) ACACBACACAGPR84FFAR1MEN1
SCHEMBL28184370 0.98 ACACB (0.35) ACACBACACAGPR84FFAR1MEN1
SCHEMBL28022900 0.86 GRN (0.35) MEN1RECQLKMT2ACA2TDP1
SCHEMBL28183575 0.85 LMNA (0.49) GPR84FFAR1MEN1KMT2AMAPT
SCHEMBL28023391 0.85 LMNA (0.49) GPR84FFAR1MEN1KMT2AMAPT
SCHEMBL28022710 0.85 LMNA (0.49) GPR84FFAR1MEN1KMT2AMAPT
SCHEMBL28023526 0.83 ACACB (0.40) ACACBACACAGPR84FFAR1MAPT
SCHEMBL28023415 0.83 ACACB (0.40) ACACBACACAGPR84FFAR1MAPT
SCHEMBL6003876 0.83 GPR84 (0.50) GPR84FFAR1MEN1HPGDRECQL
SCHEMBL10342900 0.83 GPR84 (0.50) GPR84FFAR1MEN1HPGDRECQL

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