SCHEMBL28070997

SCHEMBL28070997

O=C(O)Cc1ccnc(C2CNCCO2)n1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 5/20 0.40
SLC6A3 Q01959 4/20 0.40
KCNH2 Q12809 3/20 0.40

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
SCHEMBL28059111 0.84 DRD2 (0.40) TAAR1SLC6A3KCNH2
SCHEMBL28059202 0.74 TAAR1 (0.46) TAAR1SLC6A3
SCHEMBL27635980 0.74 SLC6A3 (0.46) TAAR1SLC6A3KCNH2
SCHEMBL29034235 0.72 KDM4E (0.43) TAAR1SLC6A3KCNH2
SCHEMBL913262 0.71 DRD2 (0.46)
SCHEMBL29034234 0.71
SCHEMBL18342698 0.71 SLC6A3 (0.39) TAAR1SLC6A3
SCHEMBL6554177 0.70
Hydrogen Sulfide SCHEMBL28070942 0.70 DRD2 (0.45)
Sulfur Dioxide SCHEMBL28071143 0.69 DRD2 (0.42)

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-105814049-B Fused tricyclic imdazole derivatives as TNF active regulator UCB生物制药私人有限公司 2019-03-12 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-105814058-B Triazolo-pyridazine derivatives as TNF active regulator UCB生物制药私人有限公司 2018-11-23 CN disclosed
CN-105814047-B Fused tricyclic imdazole derivatives as TNF active regulators UCB生物制药私人有限公司 2018-10-19 CN disclosed
CN-105814022-B Condensed bicyclic heteroaromatic derivative as TNF active regulators UCB生物制药私人有限公司 2018-09-28 CN disclosed
CN-105814051-B Tetrahydroimidazopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2018-09-25 CN disclosed
CN-105814025-B Tetrahydrobenzimidazderivative derivative as TNF active regulators UCB生物制药私人有限公司 2018-09-04 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-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-105814047-A Fused tricyclic benzimidazoles derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814025-A Tetrahydrobenzimidazole 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-105814049-A Fused tricyclic imidazole 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-105814022-A Fused bicyclic heteroaromatic derivatives as modulators of tnf activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814048-A Fused tricyclic imidazole 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