SCHEMBL10568608

SCHEMBL10568608

CCOC(=O)c1c(C(F)(F)F)nc(C(F)(F)F)c(CC)c1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.49
IDO1 P14902 1/20 0.43
LMNA P02545 1/20 0.42
PKM P14618 1/20 0.42
ALDH1A1 P00352 5/20 0.41
HPGD P15428 4/20 0.41
MAPT P10636 4/20 0.41
GAA P10253 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
ADORA3 P0DMS8 2/20 0.39
RORC P51449 1/20 0.39
FHIT P49789 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL10370830 0.90 KDM4E (0.55) KDM4EIDO1LMNAPKMALDH1A1
SCHEMBL9726378 0.86 KDM4E (0.48) KDM4EIDO1LMNAPKMALDH1A1
SCHEMBL10362929 0.84 KDM4E (0.44) KDM4EIDO1LMNAPKMALDH1A1
SCHEMBL10688342 0.80 KDM4E (0.44) KDM4EIDO1LMNAPKMALDH1A1
SCHEMBL9726366 0.80 KDM4E (0.50) KDM4EIDO1LMNAPKMALDH1A1
SCHEMBL10370033 0.79 KDM4E (0.49) KDM4EIDO1LMNAPKMALDH1A1
SCHEMBL10369986 0.78 KDM4E (0.47) KDM4EIDO1LMNAPKMALDH1A1
SCHEMBL26620725 0.78 KDM4E (0.59) KDM4EIDO1LMNAPKMALDH1A1
SCHEMBL10373408 0.77 KDM4E (0.48) KDM4EIDO1LMNAPKMALDH1A1
SCHEMBL10370416 0.77 KDM4E (0.48) KDM4EIDO1LMNAPKMALDH1A1

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
US-4835279-A 2,6-substituted pyridine compounds MONSANTO COMPANY (US) 1989-05-30 US disclosed