SCHEMBL28071023

SCHEMBL28071023

CCN1CCNCC1C#N

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL4659262 0.81
SCHEMBL1583060 0.81
SCHEMBL1583188 0.79
SCHEMBL10498523 0.77 DPP4 (0.32)
SCHEMBL48946 0.74
SCHEMBL27584032 0.74
SCHEMBL28936797 0.73 DPP4 (0.34)
Hydrazine SCHEMBL17761197 0.72
SCHEMBL8660520 0.72 SIGMAR1 (0.47)
SCHEMBL12310244 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106938990-B A method of by allyl tertiary amine compounds one-step synthesis cyano tertiary amine compounds 北京理工大学 2019-09-17 CN disclosed
CN-105814043-B Triazolopyridine derivatives as TNF active regulator UCB生物制药私人有限公司 2019-05-17 CN disclosed
CN-105814041-B Benzotriazole derivatives as TNF active regulator UCB生物制药私人有限公司 2018-12-18 CN disclosed
CN-105814065-B Imidazothiazole derivative as TNF active regulator UCB生物制药私人有限公司 2018-11-23 CN disclosed
CN-105814050-B Pyrazolopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2018-05-08 CN disclosed
CN-105814060-B Imidazo-triazine derivative as TNF active regulators UCB生物制药私人有限公司 2018-02-13 CN disclosed
CN-106938990-A A kind of method by pi-allyl tertiary amine compounds one-step synthesis cyano group tertiary amine compounds 北京理工大学 2017-07-11 CN disclosed
CN-105814065-A Imidazothiazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814051-A Tetrahydroimidazopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814050-A Pyrazolopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814058-A Triazolopyridazine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814043-A Triazolopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814060-A Imidazotriazine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed