SCHEMBL18780239

SCHEMBL18780239

CC(O)Sc1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.56
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 1/20 0.51
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAPK1 P28482 1/20 0.46
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
PLAU P00749 1/20 0.44

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
SCHEMBL6970770 0.78 PKM (0.50) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL28895677 0.76 KMT2A (0.62) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL7821180 0.75 PKM (0.54) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL6970766 0.75 ALDH1A1 (0.49) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL2034010 0.73 PKM (0.43) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL7676239 0.72 NPSR1 (0.56) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL9967732 0.71 KMT2A (0.61) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL16592104 0.71 NPSR1 (0.55) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL19297913 0.70 AGBL2 (0.41) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL22809569 0.70 PKM (0.52) PKMSMN1; SMN2ALDH1A1KDM4EKMT2A

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
EP-2923571-B1 HERBICIDE COMPOSITION SUMITOMO CHEMICAL CO (JP) 2017-04-26 EP disclosed