SCHEMBL28378347

SCHEMBL28378347

CCCCCC[n+]1ccn(C)c1C.F[P-](F)(F)(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.55
CA2 P00918 5/20 0.55
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
EEF2K O00418 2/20 0.41
EEF2 P13639 2/20 0.41
PLK4 O00444 1/20 0.41
JAK2 O60674 1/20 0.41
EGFR P00533 1/20 0.41
TYK2 P29597 1/20 0.41
FLT3 P36888 1/20 0.41
BLM P54132 1/20 0.41
ITK Q08881 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
HTT P42858 3/20 0.41
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 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
SCHEMBL20490656 0.93 CA1 (0.46) CA1CA2MEN1KMT2AEEF2K
SCHEMBL4068859 0.93 CA1 (0.61) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5304227 0.93 CA1 (0.61) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5293864 0.93 CA1 (0.61) CA1CA2MEN1KMT2AEEF2K
SCHEMBL4059675 0.93 CA1 (0.61) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5287243 0.93 CA1 (0.61) CA1CA2MEN1KMT2AEEF2K
SCHEMBL1826848 0.93 CA1 (0.61) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5295196 0.93 CA1 (0.61) CA1CA2MEN1KMT2AEEF2K
SCHEMBL4070935 0.93 CA1 (0.61) CA1CA2MEN1KMT2AEEF2K
SCHEMBL372253 0.93 CA1 (0.61) CA1CA2MEN1KMT2AEEF2K

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110961055-A Ionic liquid polymeric microspheres and preparation method and application thereof 锦州医科大学 2020-04-07 CN claimed
CN-110961055-B Ionic liquid polymeric microspheres and preparation method and application thereof 锦州医科大学 2021-01-05 CN disclosed
CN-110961055-A Ionic liquid polymeric microspheres and preparation method and application thereof 锦州医科大学 2020-04-07 CN disclosed