SCHEMBL9618709

SCHEMBL9618709

Cn1cc(C(F)(F)C(F)(F)C(F)(F)F)c(=O)n(C)c1=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.36
KDM4E B2RXH2 1/20 0.33
LMNA P02545 2/20 0.33
TSHR P16473 4/20 0.32
HSD17B10 Q99714 1/20 0.32
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 2/20 0.31
ALOX15 P16050 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL30668132 0.95 ATM (0.35) ATMKDM4ELMNATSHRHSD17B10
SCHEMBL1270636 0.81 ATM (0.39) ATMKDM4ELMNATSHRHSD17B10
SCHEMBL17035909 0.81 ATM (0.39) ATMKDM4ELMNATSHRHSD17B10
SCHEMBL17035904 0.79 ATM (0.41) ATMLMNATSHRHSD17B10KMT2A
SCHEMBL9465457 0.78 ATM (0.34) ATMLMNAALDH1A1
SCHEMBL12766925 0.75 LMNA (0.40) ATMLMNATSHRHSD17B10KMT2A
SCHEMBL3189250 0.66 TSHR (0.44) ATMKDM4ELMNATSHRHSD17B10
Potassium Ion SCHEMBL31354832 0.64 ATM (0.35) ATMKDM4ELMNATSHRHSD17B10
SCHEMBL17254245 0.63 ERN1 (0.37) KDM4ELMNATSHRHSD17B10HTT
SCHEMBL566202 0.62 GAA (0.43) KDM4ELMNATSHRHTTSMN1; SMN2

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
JP-4352769-A None JP disclosed
JP-H04352769-A FLUOROALKYL GROUP-CONTAINING URACIL DERIVATIVE AND PRODUCTION THEREOF NIPPON OIL & FATS CO LTD 1992-12-07 JP disclosed