SCHEMBL28022894

SCHEMBL28022894

CCCCCCC(C)C(=O)OC1C=Cc2cccc3cccc1c23

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CNR1 P21554 3/20 0.32
CNR2 P34972 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA1 P00915 2/20 0.31
FAAH O00519 1/20 0.31
PPARG P37231 2/20 0.30
PPARA Q07869 2/20 0.30

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
SCHEMBL28948789 1.00 KDM4E (0.36) KDM4EKMT2AL3MBTL1PRSS1PRSS2
SCHEMBL28022732 0.96 CA2 (0.33) KDM4EKMT2AL3MBTL1PRSS1PRSS2
SCHEMBL28820915 0.91 TSHR (0.34) KDM4EKMT2AL3MBTL1LMNAALDH1A1
SCHEMBL28023395 0.88 KDM4E (0.33) KDM4EKMT2AL3MBTL1PRSS1PRSS2
SCHEMBL28023393 0.87 KDM4E (0.32) KDM4EKMT2AL3MBTL1PRSS1PRSS2
SCHEMBL28023380 0.86 LMNA (0.31) LMNA
SCHEMBL28820887 0.83 HDAC3 (0.33) LMNACA1PPARGPPARA
SCHEMBL28023345 0.82 NAAA (0.38) KMT2AALDH1A1PPARGPPARA
SCHEMBL28023549 0.81 KDM4E (0.32) KDM4EALDH1A1
SCHEMBL28022906 0.81 POLM (0.36) KMT2AALDH1A1PPARGPPARA

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