SCHEMBL28022835

SCHEMBL28022835

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

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.38
GPR84 Q9NQS5 3/20 0.36
FFAR1 O14842 1/20 0.36
MAPT P10636 1/20 0.35
LCK P06239 1/20 0.35
PPARD Q03181 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CA2 P00918 2/20 0.33
ACE2 Q9BYF1 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL28023425 1.00 TRPV1 (0.38) TRPV1GPR84FFAR1MAPTLCK
SCHEMBL28184378 0.95 TSHR (0.35) TRPV1CYP3A4TSHRATMTDP1
SCHEMBL27747278 0.86 GPR84 (0.46) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8447024 0.85 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8864030 0.85 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7758415 0.85 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7758405 0.85 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8192721 0.85 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL2792012 0.85 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7758400 0.85 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD

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 3 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-B Ziegler natta catalyst system of internal donor and preparation method thereof is used as comprising 1,2 phenylene diester 印度石油有限公司 2017-11-07 CN disclosed
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