SCHEMBL29577112

SCHEMBL29577112

O=C1CCN(C2CC2)c2cc(F)c(F)cc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.33
HTR2C P28335 1/20 0.33
GRIA1 P42261 3/20 0.33
GRIA2 P42262 3/20 0.33
GRIA3 P42263 3/20 0.33
GRIA4 P48058 3/20 0.33
MAPK1 P28482 1/20 0.33
TOP2A P11388 1/20 0.32
HTR1A P08908 1/20 0.31
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
HTR1F P30939 1/20 0.31
CHRNA1 P02708 2/20 0.31
CHRNB2 P17787 2/20 0.31
CHRNB4 P30926 2/20 0.31
CHRNA3 P32297 2/20 0.31
CHRNA4 P43681 2/20 0.31
HDAC1 Q13547 2/20 0.31
HDAC8 Q9BY41 2/20 0.31
HDAC6 Q9UBN7 2/20 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
SCHEMBL8486770 1.00 PDE4A (0.33) PDE4AHTR2CGRIA1GRIA2GRIA3
SCHEMBL22774826 0.88 PDE4A (0.42) PDE4AHTR2CGRIA1GRIA2GRIA3
SCHEMBL29576542 0.88 PDE4A (0.42) PDE4AHTR2CGRIA1GRIA2GRIA3
SCHEMBL28776450 0.82 TOP2A (0.50) HTR2CTOP2AHTR1A
SCHEMBL22774193 0.82 TOP2A (0.50) GRIA1GRIA2GRIA3GRIA4TOP2A
SCHEMBL29576674 0.82 TOP2A (0.50) GRIA1GRIA2GRIA3GRIA4TOP2A
SCHEMBL29724074 0.82 TOP2A (0.50) HTR2CTOP2AHTR1A
SCHEMBL8882721 0.79 CYP11B2 (0.34) TOP2AGPBAR1
SCHEMBL28673653 0.79 MAPT (0.47) TOP2A
SCHEMBL22774032 0.78 SRD5A1 (0.37) HTR2CMAPK1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4073063-A1 HETEROCYCLIC COMPOUNDS AS MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) Ryvu Therapeutics S.A. (PL) 2022-10-19 EP disclosed
CN-114787147-A Heterocyclic compounds as modulators of interferon gene Stimulators (STING) 雷沃医疗有限公司 2022-07-22 CN disclosed
EP-3983078-A1 NEXT-GENERATION MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) Ryvu Therapeutics S.A. (PL) 2022-04-20 EP disclosed