SCHEMBL11745806

SCHEMBL11745806

COc1c(Cl)cc(-c2ccc(=O)[nH]n2)cc1Cl.[NaH]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
PDE4B Q07343 5/20 0.56
PDE4A P27815 4/20 0.56
PDE4C Q08493 4/20 0.56
PDE4D Q08499 4/20 0.56
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
PDE3A Q14432 8/20 0.48
PDE3B Q13370 7/20 0.48
CYP1A2 P05177 2/20 0.48
HPGD P15428 2/20 0.48
TP53 P04637 1/20 0.48
CYP2C9 P11712 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
CYP2C19 P33261 1/20 0.48
BLM P54132 1/20 0.48
PMP22 Q01453 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MAPT P10636 1/20 0.40

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
SCHEMBL11717978 0.98 LMNA (0.58) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL11734973 0.97 LMNA (0.56) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL11742687 0.97 LMNA (0.56) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL11738292 0.83 LMNA (0.57) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL11005422 0.81 PDE4A (0.72) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL11731953 0.81 PDE4A (0.46) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL21550 0.81 LMNA (0.59) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL11736896 0.81 PDE4A (0.76) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL11742209 0.80 CYP1A2 (0.56) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL11740713 0.80 LMNA (0.57) LMNAPDE4BPDE4APDE4CPDE4D

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-4052395-A AGRICULTURAL FUNGICIDAL COMPOSITIONS CONTAINING 6-(SUBSTITUTED PHENYL)-PYRIDAZINONES AND SAID PYRIDAZINONES SANKYO COMPANY LIMITED (JA) 1977-10-04 US disclosed