SCHEMBL11116797

SCHEMBL11116797

Cc1cc(=O)[nH]nc1-c1ccc(N)cc1.Nc1ccc(-c2ccc(=O)[nH]n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
PDE3B Q13370 7/20 0.48
PDE3A Q14432 7/20 0.48
CYP1A2 P05177 2/20 0.47
PDE4A P27815 3/20 0.46
PDE4B Q07343 3/20 0.46
PDE4C Q08493 3/20 0.46
PDE4D Q08499 3/20 0.46
HRH3 Q9Y5N1 2/20 0.44
MAPT P10636 1/20 0.44
PDGFRB P09619 2/20 0.43
CDK8 P49336 2/20 0.43
NTRK3 Q16288 2/20 0.43
NTRK2 Q16620 2/20 0.43
AURKB Q96GD4 2/20 0.43
MET P08581 1/20 0.43
ROCK1 Q13464 1/20 0.43
CLK4 Q9HAZ1 1/20 0.43

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
SCHEMBL934680 0.90 PDE3B (0.56) LMNAMEN1KMT2APDE3BPDE3A
SCHEMBL1392640 0.83 LMNA (0.67) LMNAMEN1KMT2APDE3BPDE3A
Hydrochloric Acid SCHEMBL7316011 0.82 LMNA (0.65) LMNAMEN1KMT2APDE3BPDE3A
SCHEMBL10353678 0.82 PDE3B (0.63) LMNAMEN1KMT2APDE3BPDE3A
Cadaverine Tartrate SCHEMBL8944439 0.78 PDGFRB (0.49) LMNAPDE3BPDE3AHRH3PDGFRB
SCHEMBL3346610 0.75 LMNA (0.60) LMNAMEN1KMT2APDE3BPDE3A
SCHEMBL3452908 0.74 LMNA (0.80) LMNAMEN1KMT2APDE3BPDE3A
SCHEMBL2844945 0.74 PDE3B (0.56) PDE3BPDE3AHRH3PDGFRBCDK8
SCHEMBL8481283 0.74 PDGFRB (0.59) MEN1KMT2APDE3BPDE3ACYP1A2
SCHEMBL11474002 0.74 PDE3B (0.56) LMNAMEN1KMT2APDE3BPDE3A

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
EP-0116853-A1 Pyridazinones, processes for preparing them, therapeutical compositions containing these compounds and their use BASF Aktiengesellschaft (DE) 1984-08-29 EP disclosed