SCHEMBL3843205

SCHEMBL3843205

Cc1nn(Cc2ccccc2)c(=O)c(-c2c(F)cccc2Cl)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.44
AKR1B1 P15121 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 2/20 0.42
SLC22A12 Q96S37 1/20 0.42
RIPK1 Q13546 1/20 0.41
PDE5A O76074 2/20 0.40
ADORA1 P30542 2/20 0.40
PDE6D O43924 1/20 0.40
PDE6A P16499 1/20 0.40
PDE6G P18545 1/20 0.40
ADORA2B P29275 1/20 0.40
PDE6B P35913 1/20 0.40
PDE6C P51160 1/20 0.40
PDE6H Q13956 1/20 0.40
MAPK1 P28482 1/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL2484646 0.80 MAPT (0.44) KMT2AMEN1ALDH1A1LMNAMAPK1
SCHEMBL17628501 0.78 POLB (0.56) KMT2AMEN1ALDH1A1POLBPDE5A
SCHEMBL8901048 0.77 POLB (0.47) KMT2AMEN1ALDH1A1LMNAPOLB
SCHEMBL469888 0.76 PDE5A (0.45) KMT2AMEN1ALDH1A1POLBPDE5A
SCHEMBL30388561 0.74 HPD (0.36) KMT2AMEN1ALDH1A1LMNA
SCHEMBL27992351 0.74 PDE5A (0.43) KMT2AMEN1ALDH1A1POLBPDE5A
SCHEMBL20551734 0.73 ALDH1A1 (0.40) KMT2AMEN1ALDH1A1POLBPDE5A
SCHEMBL8902547 0.73 SMN1; SMN2 (0.46) KMT2AMEN1ALDH1A1LMNAPOLB
SCHEMBL8903051 0.71 LMNA (0.43) KMT2AMEN1ALDH1A1LMNAPOLB
SCHEMBL22031792 0.71 CASR (0.40) KMT2ALMNA

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
EP-2042491-A1 Pyridazines as fungicides Bayer CropScience AG (DE) 2009-04-01 EP disclosed
EP-2042491-A1 Pyridazines as fungicides Bayer CropScience AG (DE) 2009-04-01 EP disclosed