SCHEMBL11225319

SCHEMBL11225319

CCNc1nn(CC)c2ncc(-c3ccncc3)cc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 1/20 0.40
LATS2 Q9NRM7 1/20 0.40
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 6/20 0.38
HSD17B10 Q99714 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 1/20 0.38
USP2 O75604 2/20 0.38
LMNA P02545 1/20 0.38
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
PGK1 P00558 1/20 0.36
CHEK1 O14757 1/20 0.36
PDGFRB P09619 3/20 0.35
PDGFRA P16234 3/20 0.35
NR1D1 P20393 1/20 0.35
HPGD P15428 4/20 0.35
CASP1 P29466 3/20 0.35

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
SCHEMBL11229759 0.86 GSK3B (0.46) LATS1LATS2ALDH1A1KDM4EHSD17B10
SCHEMBL11231701 0.83 PABPC1 (0.51) ALDH1A1KDM4EHSD17B10L3MBTL1TP53
SCHEMBL11129400 0.81 ADORA2A (0.41) ALDH1A1KDM4EHSD17B10L3MBTL1SMN1; SMN2
SCHEMBL11235570 0.80 GSK3B (0.51) ALDH1A1KDM4EHSD17B10GSK3AGSK3B
SCHEMBL11232136 0.77 LATS1 (0.38) LATS1LATS2ALDH1A1KDM4EHSD17B10
SCHEMBL11229298 0.77 LATS1 (0.40) LATS1LATS2ALDH1A1KDM4EHSD17B10
SCHEMBL11280195 0.77 GSK3B (0.37) ALDH1A1KDM4EHSD17B10L3MBTL1LMNA
SCHEMBL11232705 0.73 PDGFRB (0.38) LATS1LATS2ALDH1A1KDM4EHSD17B10
SCHEMBL11231822 0.73 GSK3A (0.37) ALDH1A1KDM4EHSD17B10L3MBTL1TP53
SCHEMBL11233210 0.72 MEN1 (0.43) ALDH1A1KDM4EHSD17B10L3MBTL1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4361568-A 5-(Pyridinyl)-1H-pyrazolo[3,4-b]pyridin-3-amines and their cardiotonic use STERLING DRUG INC. (US) 1982-11-30 US disclosed