SCHEMBL6326523

SCHEMBL6326523

O=C(O)c1ccccc1C(F)(F)F.O=C1CO1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
TAS2R14 Q9NYV8 2/20 0.47
ALDH1A1 P00352 2/20 0.46
FABP4 P15090 1/20 0.46
CTNNB1 P35222 3/20 0.44
WNT3A P56704 3/20 0.44
ALOX15 P16050 1/20 0.43
GRIK1 P39086 1/20 0.43
KCNK3 O14649 1/20 0.42
KCNK9 Q9NPC2 1/20 0.42
RBP4 P02753 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTR2B P41595 1/20 0.42
MAPK14 Q16539 1/20 0.42

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
SCHEMBL221518 0.87 LMNA (0.62) MEN1KMT2ALMNAGAATAS2R14
SCHEMBL30449216 0.87 LMNA (0.62) MEN1KMT2ALMNAGAATAS2R14
Ammonia Solution, Strong SCHEMBL27794593 0.85 LMNA (0.60) MEN1KMT2ALMNAGAATAS2R14
SCHEMBL27815762 0.85 LMNA (0.60) MEN1KMT2ALMNAGAATAS2R14
SCHEMBL27794599 0.85 LMNA (0.60) MEN1KMT2ALMNAGAATAS2R14
Hydrochloric Acid SCHEMBL2533965 0.85 LMNA (0.60) MEN1KMT2ALMNAGAATAS2R14
SCHEMBL27815764 0.85 LMNA (0.60) MEN1KMT2ALMNAGAATAS2R14
SCHEMBL9461001 0.85 LMNA (0.60) MEN1KMT2ALMNAGAATAS2R14
SCHEMBL29208535 0.85 LMNA (0.60) MEN1KMT2ALMNAGAATAS2R14
Ethylene SCHEMBL714453 0.83 LMNA (0.58) MEN1KMT2ALMNAGAATAS2R14

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-20050267516-A1 Embolic protection device for the prevention of stroke SOLEIMANI FARZAD 2005-12-01 US disclosed