SCHEMBL11225855

SCHEMBL11225855

Cc1nc2c(cc1-c1ccncc1)c(N(C)C)nn2C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 11/20 0.49
PDE3A Q14432 11/20 0.49
HAVCR2 Q8TDQ0 1/20 0.37
LATS1 O95835 1/20 0.37
LATS2 Q9NRM7 1/20 0.37
HPGD P15428 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
CLK1 P49759 1/20 0.35
UBE2N P61088 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPK11 Q15759 2/20 0.34
MAPK14 Q16539 2/20 0.34
ADK P55263 1/20 0.34
ROCK2 O75116 1/20 0.33
ROCK1 Q13464 1/20 0.33
CSNK1D P48730 1/20 0.33
APAF1 O14727 1/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL11237388 0.84 PDE3B (0.44) PDE3BPDE3AHAVCR2LATS1LATS2
SCHEMBL11232990 0.81 PDE3B (0.51) PDE3BPDE3AHAVCR2HPGDALDH1A1
SCHEMBL11223425 0.75 PDE3B (0.46) PDE3BPDE3ALATS1LATS2HPGD
SCHEMBL11232476 0.75 GSK3B (0.49) PDE3BPDE3ALATS1LATS2HPGD
SCHEMBL11235524 0.74 KDM4E (0.56) PDE3BPDE3AHPGDALDH1A1MAPK1
SCHEMBL11238631 0.72 PDE3B (0.39) PDE3BPDE3AHAVCR2LATS1LATS2
SCHEMBL11174688 0.71 PDE3B (0.53) PDE3BPDE3AALDH1A1MAPK11MAPK14
SCHEMBL11391437 0.69 PDE3B (0.57) PDE3BPDE3AHAVCR2HPGDROCK2
SCHEMBL11240784 0.68 PDE3B (0.46) PDE3BPDE3AHPGDALDH1A1MAPK1
SCHEMBL11174660 0.65 PDE3B (0.56) PDE3BPDE3AALDH1A1RECQL

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-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
EP-0063754-A1 Pyrazolopyridine derivatives, and preparation, useful as cardiotonics STERLING DRUG INC. (US) 1982-11-03 EP disclosed