SCHEMBL8115136

SCHEMBL8115136

Clc1cccc(N2CCC3CCc4cnccc4C3=N2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 2/20 0.42
NPC1 O15118 1/20 0.42
GLA P06280 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP3 P42574 1/20 0.42
RECQL P46063 1/20 0.42
RAB9A P51151 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP11B2 P19099 4/20 0.38
CYP11B1 P15538 3/20 0.38
ROCK2 O75116 4/20 0.37
LMNA P02545 3/20 0.36
MAPK11 Q15759 1/20 0.36

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
SCHEMBL8123737 0.86 ALDH1A1 (0.42) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8123913 0.81 KDM4E (0.44) KDM4EALDH1A1SMN1; SMN2GAANPC1
SCHEMBL8130034 0.79 MAPT (0.42) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8122081 0.77 ALDH1A1 (0.42) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8149239 0.73 GAA (0.35) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8578786 0.72 KDM4E (0.61) KDM4EALDH1A1SMN1; SMN2GAANPC1
SCHEMBL8127824 0.70 KCNH2 (0.39) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8124757 0.70 ALDH1A1 (0.39) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8124327 0.65 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2GAANPC1
SCHEMBL8607073 0.64 KDM4E (0.49) KDM4EALDH1A1GAANPC1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015450-A1 NOVEL PYRIDAZINE COMPOUNDS AstraZeneca UK Limited (GB) 2000-07-05 EP claimed
WO-1997045428-A1 NOVEL PYRIDAZINE COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1997-12-04 WO claimed
EP-1015450-A1 NOVEL PYRIDAZINE COMPOUNDS AstraZeneca UK Limited (GB) 2000-07-05 EP disclosed
US-5935956-A Pyridazine compounds ASTRA PHARMACEUTICALS LTD. (GB) 1999-08-10 US disclosed
WO-1997045428-A1 NOVEL PYRIDAZINE COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1997-12-04 WO disclosed