SCHEMBL28099739

SCHEMBL28099739

CC(O)CNCCN.CC(O)CNCCN.CC(O)CNCCN.Cl[Co](Cl)Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.39
KMT2A Q03164 4/20 0.38
CA12 O43570 3/20 0.38
CA6 P23280 3/20 0.38
CA7 P43166 3/20 0.38
CA9 Q16790 3/20 0.38
CA14 Q9ULX7 3/20 0.38
CA5B Q9Y2D0 3/20 0.38
MEN1 O00255 3/20 0.38
RECQL P46063 1/20 0.38
LMNA P02545 3/20 0.36
TDP1 Q9NUW8 3/20 0.36
ALDH1A1 P00352 3/20 0.36
CA2 P00918 2/20 0.36
CA3 P07451 2/20 0.36
CA4 P22748 2/20 0.36
CA5A P35218 2/20 0.36
CA1 P00915 1/20 0.36
ALOX15 P16050 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL19774600 0.91
SCHEMBL169586 0.91
SCHEMBL27794421 0.89
SCHEMBL11014748 0.89 CA12 (0.48) ANPEPKMT2ACA12CA6CA7
SCHEMBL3925022 0.86 CA12 (0.52) ANPEPKMT2ACA12CA6CA7
SCHEMBL9733941 0.86 CA12 (0.52) ANPEPKMT2ACA12CA6CA7
SCHEMBL5425015 0.86 CA12 (0.52) ANPEPKMT2ACA12CA6CA7
SCHEMBL9168490 0.86 CA12 (0.52) ANPEPKMT2ACA12CA6CA7
Methane SCHEMBL29109500 0.84 CA12 (0.50) ANPEPKMT2ACA12CA6CA7
Charcoal, Activated SCHEMBL30662618 0.84 CA12 (0.50) ANPEPKMT2ACA12CA6CA7

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-108467359-A A kind of copper complex 合肥祥晨化工有限公司 2018-08-31 CN disclosed
CN-106008611-B A kind of Chiral cobalt complex 合肥工业大学 2018-05-25 CN disclosed
CN-106117251-B A kind of copper complex 合肥祥晨化工有限公司 2017-11-24 CN disclosed
CN-105669710-B A kind of preparation of copper complex crystal and its synthetic method 合肥祥晨化工有限公司 2017-08-29 CN disclosed
CN-106432359-A Chiral nickel complex 合肥祥晨化工有限公司 2017-02-22 CN disclosed
CN-106220519-A Preparation and synthesis method of cobalt complex 合肥祥晨化工有限公司 2016-12-14 CN disclosed
CN-106117178-A A kind of cobalt complex 合肥工业大学 2016-11-16 CN disclosed
CN-106117251-A A kind of copper complex 合肥祥晨化工有限公司 2016-11-16 CN disclosed
CN-106117250-A Copper complex 合肥祥晨化工有限公司 2016-11-16 CN disclosed
CN-106083901-A A kind of copper complex 合肥工业大学 2016-11-09 CN disclosed
CN-106008611-A Chiral cobalt complex 合肥工业大学 2016-10-12 CN disclosed