SCHEMBL7956946

SCHEMBL7956946

Fc1cccc(Cl)c1-c1c(Cl)nc2ncnn2c1Sc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
ENPP1 P22413 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
GFER P55789 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PDE2A O00408 1/20 0.33
MAPK14 Q16539 2/20 0.33
LMNA P02545 2/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
PTGES O14684 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
WEE1 P30291 1/20 0.32
POLB P06746 2/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL4821535 0.92 ALDH1A1 (0.36) ALDH1A1ENPP1KMT2APDE2AMAPK14
SCHEMBL7957236 0.89 ALDH1A1 (0.37) ALDH1A1ENPP1KMT2APDE2ALMNA
SCHEMBL7961823 0.87 ALDH1A1 (0.37) ALDH1A1ENPP1KMT2AMEN1GAA
SCHEMBL7954904 0.86 ALDH1A1 (0.39) ALDH1A1ENPP1KMT2AMEN1GAA
SCHEMBL7961666 0.85 ALDH1A1 (0.35) ALDH1A1KMT2AMEN1GAAGFER
SCHEMBL7956372 0.85 LMNA (0.40) ALDH1A1ENPP1KMT2AMEN1GAA
SCHEMBL4819686 0.84 ALDH1A1 (0.37) ALDH1A1ENPP1KMT2AMEN1GAA
SCHEMBL7955290 0.84 NPC1 (0.38) ALDH1A1ENPP1KMT2AMEN1GAA
SCHEMBL4820458 0.82 ALDH1A1 (0.35) ALDH1A1ENPP1KMT2AMEN1PDE2A
SCHEMBL7958677 0.82 ALDH1A1 (0.37) ALDH1A1ENPP1KMT2AMEN1GAA

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
US-6277857-B1 EXCELLENT SELECTIVE FUNGICIDAL ACTIVITY AGAINST VARIOUS CROP PHYTOPATHOGENS AMERICAN CYANAMID COMPANY 2001-08-21 US claimed
US-6277857-B1 EXCELLENT SELECTIVE FUNGICIDAL ACTIVITY AGAINST VARIOUS CROP PHYTOPATHOGENS AMERICAN CYANAMID COMPANY 2001-08-21 US disclosed