SCHEMBL10696215

SCHEMBL10696215

O=c1cc(C(F)(F)F)[nH]c(=O)n1Cc1ccc(Cl)cc1F

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 3/20 0.43
HSP90B1 P14625 3/20 0.43
TRAP1 Q12931 3/20 0.43
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
OPRM1 P35372 2/20 0.41
TP53 P04637 1/20 0.40
HTR1A P08908 1/20 0.40
HTR2A P28223 1/20 0.40
HTR7 P34969 1/20 0.40
HTR6 P50406 1/20 0.40
DDR1 Q08345 7/20 0.39
AKR1A1 P14550 1/20 0.39
AKR1B1 P15121 1/20 0.39
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
BCAT2 O15382 1/20 0.38
BCAT1 P54687 1/20 0.38

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
SCHEMBL9237639 0.83 MAOB (0.44) KMT2ABCAT2BCAT1
SCHEMBL8820735 0.77 ALDH1A1 (0.43) HSP90AA1HSP90B1TRAP1KMT2AKDM4E
SCHEMBL6802264 0.77 BCAT2 (0.42) HSP90AA1HSP90B1TRAP1KMT2AKDM4E
SCHEMBL8525560 0.76 ALDH1A1 (0.50) KMT2AKDM4EALDH1A1
SCHEMBL29574224 0.76 BCAT1 (0.54) ALDH1A1BCAT2BCAT1
SCHEMBL8691597 0.76 BCAT1 (0.54) ALDH1A1BCAT2BCAT1
SCHEMBL8924655 0.73 MKNK1 (0.39) HSP90AA1HSP90B1TRAP1KDM4EALDH1A1
SCHEMBL8818440 0.73 BCAT1 (0.50) KDM4EALDH1A1DDR1BCAT2BCAT1
SCHEMBL7471937 0.72 BCAT1 (0.40) KMT2AKDM4EALDH1A1DDR1BCAT2
SCHEMBL6966995 0.71 BCAT1 (0.50) KDM4EALDH1A1BCAT2BCAT1

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-0255047-A1 3-Aryl uraciles and their use as herbicides CIBA-GEIGY AG (CH) 1988-02-03 EP disclosed