SCHEMBL28004201

SCHEMBL28004201

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

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.52
MAPT P10636 8/20 0.40
LMNA P02545 3/20 0.40
MDM2 Q00987 2/20 0.40
ATM Q13315 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
MDM4 O15151 1/20 0.37
ALDH1A1 P00352 3/20 0.36
TTR P02766 1/20 0.35
DPP4 P27487 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL18235510 0.81 HCAR2 (0.55) HCAR2MAPTLMNAMDM2ATM
Diethyl Maleate SCHEMBL10550992 0.80 HCAR2 (0.59) HCAR2MAPTLMNAMDM2ATM
SCHEMBL992126 0.80 HCAR2 (0.59) HCAR2MAPTLMNAMDM2ATM
SCHEMBL992124 0.80 HCAR2 (0.59) HCAR2MAPTLMNAMDM2ATM
Diethyl Maleate SCHEMBL15751751 0.80 HCAR2 (0.59) HCAR2MAPTLMNAMDM2ATM
SCHEMBL3516777 0.80 HCAR2 (0.59) HCAR2MAPTLMNAMDM2ATM
SCHEMBL8416347 0.79 HCAR2 (0.57) HCAR2MAPTLMNAMDM2ATM
SCHEMBL8416349 0.79 HCAR2 (0.57) HCAR2MAPTLMNAMDM2ATM
SCHEMBL28757781 0.77 HCAR2 (0.55) HCAR2MAPTLMNAMDM2ATM
SCHEMBL31190293 0.77 HCAR2 (0.55) HCAR2MAPTLMNAMDM2ATM

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