SCHEMBL28279397

SCHEMBL28279397

CC(CC(=O)Oc1cccc2ccccc12)OC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
HSD17B10 Q99714 5/20 0.47
MAPK1 P28482 3/20 0.47
GAA P10253 2/20 0.47
PGR P06401 1/20 0.47
PTGS1 P23219 1/20 0.47
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
KMT2A Q03164 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MEN1 O00255 2/20 0.46
JAK2 O60674 1/20 0.46
USP2 O75604 1/20 0.46
ESR1 P03372 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ESR2 Q92731 1/20 0.46
KDM4E B2RXH2 2/20 0.44
TDP1 Q9NUW8 2/20 0.44

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
SCHEMBL28278499 0.87 HSD17B10 (0.45) ALDH1A1HSD17B10MAPK1GAAPGR
SCHEMBL28279396 0.85 ALDH1A1 (0.45) ALDH1A1HSD17B10MAPK1GAAPGR
SCHEMBL28279368 0.80 LMNA (0.48) ALDH1A1RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL8003388 0.80 ALDH1A1 (0.57) ALDH1A1HSD17B10MAPK1GAAPGR
SCHEMBL5907672 0.80 ALDH1A1 (0.57) ALDH1A1HSD17B10MAPK1GAAPGR
1-Naphthol SCHEMBL28544573 0.79 NPC1 (0.46) ALDH1A1HSD17B10GAARAB9ANPC1
SCHEMBL1579492 0.79 ALDH1A1 (0.55) ALDH1A1HSD17B10MAPK1GAAPGR
SCHEMBL28399465 0.78 ALDH1A1 (0.54) ALDH1A1HSD17B10MAPK1GAAPGR
SCHEMBL30874080 0.78 KMT2A (0.70) ALDH1A1HSD17B10MAPK1GAAPGR
SCHEMBL2477732 0.78 KMT2A (0.70) ALDH1A1HSD17B10MAPK1GAAPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109553705-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-109553712-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN claimed
CN-109553712-A A kind of catalytic component and its catalyst for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN claimed
CN-109553705-A A kind of catalytic component and preparation method thereof for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN claimed
CN-109553705-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-109553712-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed
CN-109553712-A A kind of catalytic component and its catalyst for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN disclosed
CN-109553705-A A kind of catalytic component and preparation method thereof for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN disclosed