SCHEMBL11235206

SCHEMBL11235206

CCCc1nc(Cl)c(Cl)cc1-c1ccncc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.38
PDE3A Q14432 2/20 0.38
GRM2 Q14416 1/20 0.36
MAPK1 P28482 1/20 0.35
GSK3B P49841 2/20 0.35
RAB9A P51151 2/20 0.34
GLP1R P43220 1/20 0.34
NPC1 O15118 1/20 0.34
HEXA P06865 1/20 0.33
HEXB P07686 1/20 0.33
LATS1 O95835 1/20 0.33
CASP1 P29466 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN11 Q06124 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL11236919 0.92 GSK3B (0.42) PDE3BPDE3AGRM2MAPK1GSK3B
SCHEMBL11236724 0.91 GSK3B (0.38) PDE3BPDE3AGRM2MAPK1GSK3B
SCHEMBL7278975 0.87 PDE3B (0.49) PDE3BPDE3AGRM2MAPK1GSK3B
SCHEMBL11241603 0.81 PDE3B (0.53) PDE3BPDE3AMAPK1KDM4EALDH1A1
SCHEMBL11233222 0.80 GSK3B (0.40) PDE3BPDE3AMAPK1GSK3BRAB9A
SCHEMBL11224797 0.79 RAB9A (0.41) PDE3BPDE3ARAB9ANPC1ALDH1A1
SCHEMBL11165295 0.79 CASP1 (0.49) CASP1MAPT
SCHEMBL11248447 0.78 SMN1; SMN2 (0.40) PDE3BPDE3AMAPK1GSK3BRAB9A
SCHEMBL7279946 0.78 PDE3B (0.36) PDE3BPDE3AGRM2MAPK1GSK3B
SCHEMBL11377753 0.77 CYP46A1 (0.49) PDE3BPDE3AMAPK1GSK3BCASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4351941-A Pyridinyl-pyridines STERLING DRUG INC. (US) 1982-09-28 US disclosed
US-4331672-A 5-(Pyridinyl)pyridine-2-hydrazines, their preparation and their cardiotonic use STERLING DRUG INC. (US) 1982-05-25 US disclosed