SCHEMBL28020539

SCHEMBL28020539

CC1(C)CO1.CCCOC(=O)c1cccc(C)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 1/20 0.53
ELANE P08246 1/20 0.49
ALDH1A1 P00352 4/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
TDP1 Q9NUW8 3/20 0.44
ADRB2 P07550 2/20 0.44
ADRB1 P08588 2/20 0.44
ADRB3 P13945 2/20 0.44
ESR1 P03372 1/20 0.44
CHRM1 P11229 1/20 0.44
TSHR P16473 1/20 0.44
SLC6A2 P23975 1/20 0.44
KDR P35968 1/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
PKM P14618 1/20 0.44
HPGD P15428 1/20 0.43

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
SCHEMBL28020497 0.92 L3MBTL1 (0.52) L3MBTL1LMNANPC1RAB9ATDP1
SCHEMBL6057282 0.89 LMNA (0.66) L3MBTL1LMNAELANEALDH1A1NPC1
SCHEMBL27545912 0.83 ADRB2 (0.55) L3MBTL1ALDH1A1NPC1RAB9ATDP1
SCHEMBL27536381 0.82 LMNA (0.57) L3MBTL1LMNAELANEALDH1A1NPC1
SCHEMBL28020066 0.82 L3MBTL1 (0.52) L3MBTL1LMNAELANEALDH1A1NPC1
SCHEMBL9044225 0.81 L3MBTL1 (0.61) L3MBTL1LMNANPC1RAB9ATDP1
SCHEMBL7530948 0.81 LMNA (0.55) L3MBTL1LMNAELANEALDH1A1NPC1
SCHEMBL27669135 0.81 L3MBTL1 (0.46) L3MBTL1ALDH1A1NPC1RAB9ATDP1
SCHEMBL30285808 0.80 CYP1A2 (0.60) L3MBTL1LMNANPC1RAB9ATDP1
SCHEMBL6057169 0.80 CYP1A2 (0.60) L3MBTL1LMNANPC1RAB9ATDP1

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-104829756-B A kind of solid catalyst component for olefine polymerization and its preparation method and application 中国科学院化学研究所 2018-05-15 CN disclosed
CN-104829756-A Solid catalyst component for olefin polymerization, and preparation method and application thereof CHINESE ACAD INST CHEMISTRY 2015-08-12 CN disclosed