SCHEMBL28569155

SCHEMBL28569155

CCOc1cccc(C(CC)C(=O)OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
KCNQ2 O43526 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
ACACB O00763 1/20 0.43
ACACA Q13085 1/20 0.43
MAPK1 P28482 3/20 0.43
HTT P42858 2/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KMT2A Q03164 1/20 0.43
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
LMNA P02545 2/20 0.42
NR1H4 Q96RI1 1/20 0.42
CYP1A2 P05177 1/20 0.41

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
SCHEMBL28577126 0.88 KDM4E (0.60) KDM4EL3MBTL1TDP1KCNQ2
SCHEMBL28584210 0.87 CACNA1B (0.52) KDM4EALDH1A1L3MBTL1TDP1ACACB
SCHEMBL28575917 0.84 PTGS1 (0.56) KDM4EALDH1A1L3MBTL1TDP1KCNQ2
SCHEMBL15266766 0.84 TP53 (0.47) KDM4EALDH1A1L3MBTL1SMN1; SMN2RXRA
SCHEMBL28576839 0.81 ACACB (0.50) ALDH1A1TDP1ACACBACACAKMT2A
SCHEMBL9326518 0.81 KDM4E (0.58) KDM4EALDH1A1L3MBTL1TDP1KCNQ2
SCHEMBL2847713 0.80 LMNA (0.46) KDM4ETDP1TSHRHSD17B10KMT2A
SCHEMBL31478057 0.79 CPN1 (0.53) KDM4EL3MBTL1TDP1KCNQ2SMN1; SMN2
SCHEMBL10958923 0.79 KDM4E (0.56) KDM4EL3MBTL1TDP1KCNQ2
SCHEMBL7112200 0.79 ALDH1A1 (0.49) KDM4EALDH1A1L3MBTL1MAPK1HTT

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-109096420-B Catalyst for olefin polymerization and olefin polymerization method 中国石油化工股份有限公司 2021-05-11 CN claimed
CN-109096420-B Catalyst for olefin polymerization and olefin polymerization method 中国石油化工股份有限公司 2021-05-11 CN disclosed