SCHEMBL3847088

SCHEMBL3847088

NN(Cc1ccccc1)C(=O)Cc1c(F)cccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.45
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
TDP1 Q9NUW8 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
TP53 P04637 1/20 0.43
TAAR1 Q96RJ0 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
SCHEMBL1285811 0.74 AKR1B1 (0.74) GAAKMT2AMAPTKDM4EALDH1A1
SCHEMBL29570152 0.74 AKR1B1 (0.74) GAAKMT2AMAPTKDM4EALDH1A1
SCHEMBL13873152 0.74 KMT2A (0.44) GAAKMT2AMAPTKDM4EALDH1A1
SCHEMBL3935646 0.73 KMT2A (0.58) GAAKMT2AMAPTLMNAKDM4E
SCHEMBL13873165 0.72 MAPK1 (0.40) GAAKMT2AMAPTKDM4EALDH1A1
SCHEMBL5254398 0.72 KDM4E (0.56) GAAKMT2AMAPTKDM4EALDH1A1
SCHEMBL6362585 0.72 TDP1 (0.57) GAAKMT2AMAPTLMNAKDM4E
SCHEMBL1885453 0.71 MAPT (0.59) GAAKMT2AMAPTKDM4EALDH1A1
SCHEMBL14814503 0.70 SMN1; SMN2 (0.56) GAAKMT2AMAPTLMNAKDM4E
SCHEMBL7639203 0.70 KMT2A (0.50) KMT2AMAPTLMNAKDM4EALDH1A1

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