SCHEMBL28068406

SCHEMBL28068406

C=CCC1CCCN1C=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
ALDH1A1 P00352 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30

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
SCHEMBL7147030 0.94 CHRNB2 (0.41) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL906504 0.83 CHRNB2 (0.38) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL1302925 0.75
SCHEMBL18320651 0.75
SCHEMBL6205356 0.75
SCHEMBL4158072 0.75
SCHEMBL1712699 0.75
SCHEMBL12311430 0.75
SCHEMBL38658025 0.75
SCHEMBL6506120 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105377918-B Cementing compositions and its component and its application method 3M创新有限公司 2017-07-11 CN claimed
CN-110418635-A Cell or tissue embeds device JAPAN VAM & POVAL CO LTD 2019-11-05 CN disclosed
CN-110418835-A cell or tissue embedding device JAPAN VAM & POVAL CO LTD 2019-11-05 CN disclosed
CN-110049869-A Extrusion matt foil with improved mechanical performance and high-weatherability 赢创罗姆有限公司 2019-07-23 CN disclosed
CN-107431210-B Anode for lithium battery 日产自动车株式会社 2019-04-16 CN disclosed
CN-108129623-A Cashew nut oil modified phenolic aldehyde acrylic resin, preparation method and application 苏州市明大高分子科技材料有限公司 2018-06-08 CN disclosed
CN-105378990-B Dispersant for resin current collector, material for resin current collector, and resin current collector 三洋化成工业株式会社 2017-12-08 CN disclosed
CN-107431210-A Anode for lithium battery 日产自动车株式会社 2017-12-01 CN disclosed
CN-107250236-A Graphite in resin is peeled off 瑞来斯实业公司 2017-10-13 CN disclosed
CN-105693926-B A kind of high-performance environment protection type dynamic hydrate inhibitor and its synthetic method 上海氟聚化学产品股份有限公司 2017-10-10 CN disclosed
CN-105693926-A Environment-friendly high-performance kinetic hydrate inhibitor and synthetic method thereof 上海氟聚化学产品有限公司 2016-06-22 CN disclosed