SCHEMBL28381093

SCHEMBL28381093

COc1ccc(C2(C#N)CCC(C(=O)O)CC2)cc1OC1CC1

nearest known ligand 0.92

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.92
PDE4A P27815 19/20 0.92
PDE4C Q08493 19/20 0.92
PDE4D Q08499 19/20 0.92

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
Cilomilast SCHEMBL26372 0.96 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL13777301 0.96 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL27515 0.96 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL5975855 0.96 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL27516 0.96 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL6904030 0.95 PDE4B (0.98) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL29107422 0.95 PDE4B (0.98) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL7130621 0.95 PDE4B (0.98) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL7130626 0.95 PDE4B (0.98) PDE4BPDE4APDE4CPDE4D
SCHEMBL5703615 0.93 PDE4B (0.79) PDE4BPDE4APDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108570048-B Substituted heteroaryl compounds, compositions and uses thereof 广东东阳光药业有限公司 2021-06-08 CN disclosed
CN-109776522-B Substituted heteroaryl compounds, compositions and uses thereof 广东东阳光药业有限公司 2020-12-29 CN disclosed
CN-105924433-B Substituted aminopyrimidine compounds and use method and application thereof 广东东阳光药业有限公司 2020-12-22 CN disclosed
CN-106749268-B Heteroaromatic compounds and their use in medicine 广东东阳光药业有限公司 2020-10-09 CN disclosed
CN-106432246-B Heteroaromatic compounds and their use in medicine 广东东阳光药业有限公司 2020-07-07 CN disclosed
CN-104418849-B Substituted aminopyrimidine compounds and use method and application thereof 广东东阳光药业有限公司 2020-04-21 CN disclosed