SCHEMBL28545946

SCHEMBL28545946

CCc1ccc(C2OC(=O)COC2=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.37
ALDH1A1 P00352 7/20 0.35
MAPK1 P28482 1/20 0.35
PARP1 P09874 1/20 0.35
SLC5A2 P31639 1/20 0.33
MGLL Q99685 2/20 0.32
KDM4E B2RXH2 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TP53 P04637 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
SCHEMBL28545968 0.88 MGLL (0.35) ALDH1A1MGLL
SCHEMBL28547883 0.85 SPHK1 (0.38) ALDH1A1SMN1; SMN2
SCHEMBL28541784 0.82 MGLL (0.35) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL28545499 0.81 ALDH1A1 (0.41) MEN1KMT2AMAPTALDH1A1
SCHEMBL28537207 0.78 ALDH1A1 (0.39) MEN1KMT2ANPSR1MAPTPOLB
SCHEMBL9303316 0.78 ALDH1A1 (0.43) MEN1KMT2AMAPTPOLBALDH1A1
SCHEMBL28911292 0.77 POLB (0.37) MAPTPOLBALDH1A1MGLLKDM4E
SCHEMBL28542569 0.75 KMT2A (0.47) MEN1KMT2ANPSR1MAPTPOLB
SCHEMBL28546594 0.74 DRD2 (0.40)
SCHEMBL28911291 0.73 ALDH1A1 (0.34) ALDH1A1MGLLKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109553708-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553709-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553707-B Catalyst component for olefin polymerization, catalyst and application 中国石油化工股份有限公司 2021-04-09 CN claimed
CN-109553708-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 CN disclosed
CN-109553709-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-04-13 CN disclosed
CN-109553707-B Catalyst component for olefin polymerization, catalyst and application 中国石油化工股份有限公司 2021-04-09 CN disclosed