SCHEMBL28004697

SCHEMBL28004697

CCOC(=O)/C=C\C(=O)OC(C)(C)Br

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.55
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
MAPT P10636 10/20 0.42
LMNA P02545 4/20 0.42
HTT P42858 1/20 0.42
MDM2 Q00987 2/20 0.41
ATM Q13315 1/20 0.41
TTR P02766 1/20 0.40
DPP4 P27487 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 4/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MDM4 O15151 1/20 0.39
CYP3A4 P08684 1/20 0.38
FDPS P14324 1/20 0.38

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
SCHEMBL1366123 0.83 HCAR2 (0.59) HCAR2CA12CA1CA2CA7
SCHEMBL1366125 0.83 HCAR2 (0.59) HCAR2CA12CA1CA2CA7
SCHEMBL28113136 0.80 HCAR2 (0.55) HCAR2CA12CA1CA2CA7
Diethyl Maleate SCHEMBL43033 0.80 HCAR2 (0.80) HCAR2CA12CA1CA2CA7
Diethyl Maleate SCHEMBL2015895 0.80 HCAR2 (0.80) HCAR2CA12CA1CA2CA7
Diethyl Maleate SCHEMBL60423 0.80 HCAR2 (0.80) HCAR2CA12CA1CA2CA7
Diethyl Maleate SCHEMBL42602 0.80 HCAR2 (0.80) HCAR2CA12CA1CA2CA7
Diethyl Maleate SCHEMBL27966383 0.80 HCAR2 (0.80) HCAR2CA12CA1CA2CA7
Diethyl Maleate SCHEMBL2015896 0.80 HCAR2 (0.80) HCAR2CA12CA1CA2CA7
Diethyl Maleate SCHEMBL138683 0.78 HCAR2 (0.76) HCAR2CA12CA1CA2CA7

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-105837714-A METHOD FOR PRODUCING SOLID CATALYST COMPONENT FOR USE IN POLYMERIZATION OF OLEFIN, CATALYST FOR USE IN POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER 东邦钛株式会社 2016-08-10 CN disclosed
CN-104470953-A Process for producing solid catalyst component for olefin polymerization, catalyst for olefin polymerization, and process for producing olefin polymer TOHO TITANIUM CO LTD 2015-03-25 CN disclosed