SCHEMBL28020119

SCHEMBL28020119

CCC1CO1.Cc1cccc(C(=O)OC(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
RAB9A P51151 4/20 0.48
MAPT P10636 4/20 0.48
NPC1 O15118 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
ELANE P08246 2/20 0.44
ADRB2 P07550 1/20 0.43
ADRB1 P08588 1/20 0.43
ADRB3 P13945 1/20 0.43
HPGD P15428 3/20 0.42
ALDH1A1 P00352 2/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 2/20 0.40

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
SCHEMBL28020069 0.85 ADRB2 (0.52) L3MBTL1RAB9AMAPTNPC1HTT
SCHEMBL6057062 0.83 RAB9A (0.58) L3MBTL1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL28020066 0.82 L3MBTL1 (0.52) L3MBTL1RAB9ANPC1ELANEADRB2
SCHEMBL28020505 0.80 L3MBTL1 (0.50) L3MBTL1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL28020512 0.79 L3MBTL1 (0.51) L3MBTL1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL28020075 0.77 KDM4E (0.49) L3MBTL1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL27567466 0.77 NPC1 (0.51) L3MBTL1RAB9AMAPTNPC1ADRB2
SCHEMBL27536387 0.76 RAB9A (0.51) L3MBTL1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL7943883 0.75 CYP1A2 (0.52) L3MBTL1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL7468235 0.75 ELANE (0.52) L3MBTL1RAB9AMAPTNPC1SMN1; SMN2

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