SCHEMBL21925892

SCHEMBL21925892

CC=Cn1ccc(N)nc1=O

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE3A Q14432 3/20 0.34
PDE4D Q08499 1/20 0.34
SLC29A1 Q99808 1/20 0.34
LMNA P02545 3/20 0.33
THRB P10828 1/20 0.33
MTOR P42345 1/20 0.33
MDM2 Q00987 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
CACNA1F O60840 2/20 0.32
ALB P02768 2/20 0.32
MAPT P10636 2/20 0.32
CACNA1D Q01668 2/20 0.32
CACNA1S Q13698 2/20 0.32
CACNA1C Q13936 2/20 0.32
FGFR1 P11362 2/20 0.31
SLC22A6 Q4U2R8 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
SCHEMBL19681300 1.00 PDE3A (0.34) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL2560842 0.80 PDE3A (0.33) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL1179743 0.79 PDE3A (0.36) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL23772976 0.77 PDE3A (0.35) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL19857181 0.77 PDE3A (0.38) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL2465397 0.77 PDE3A (0.35) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL21734464 0.75 PDE3A (0.34) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL20385875 0.73 LMNA (0.33) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL27952255 0.70 PIK3CB (0.41) PDE3APDE4DSLC29A1LMNATHRB
SCHEMBL8587873 0.69 PDE3A (0.34) PDE3APDE4DSLC29A1LMNATHRB

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-117321070-A Virus targeting to hematopoietic stem cells 麻省理工学院 2023-12-29 CN disclosed
CN-117018193-A Use of TIAR inhibitors for the treatment of hepatitis B virus infection 北京大学 2023-11-10 CN disclosed
WO-2022058734-A1 ANTIMICROBIAL AND ANTIVIRAL COATING PILKINGTON GROUP LIMITED (GB) 2022-03-24 WO disclosed
US-10852123-B2 Apparatus for critical-dimension localization microscopy GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF COMMERCE (US) 2020-12-01 US disclosed
WO-2020160399-A1 SYSTEMS AND METHODS FOR LIQUID INJECTION MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2020-08-06 WO disclosed
US-20200132437-A1 APPARATUS FOR CRITICAL-DIMENSION LOCALIZATION MICROSCOPY GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF COMMERCE 2020-04-30 US disclosed