SCHEMBL8022901

SCHEMBL8022901

FC(F)(F)c1ccccc1-c1ccccc1-c1ccccc1-c1ccccc1C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.54
NOTUM Q6P988 2/20 0.50
ALDH1A1 P00352 3/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2D6 P10635 2/20 0.47
ALOX15 P16050 2/20 0.47
CYP2C19 P33261 2/20 0.47
HSD17B10 Q99714 2/20 0.47
MAPK1 P28482 1/20 0.47
HPGD P15428 1/20 0.47
AR P10275 1/20 0.47
KCNN4 O15554 1/20 0.46
TRPA1 O75762 3/20 0.46
PSMB8 P28062 1/20 0.46
TDP1 Q9NUW8 2/20 0.44
CYP1A2 P05177 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.44
TRPV1 Q8NER1 1/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL197671 0.97 HSD11B1 (0.56) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL29010139 0.94 HSD11B1 (0.54) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6
SCHEMBL5109985 0.88 HSD11B1 (0.51) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6
SCHEMBL28818860 0.88 KCNN4 (0.51) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6
SCHEMBL27925987 0.85 KCNN4 (0.49) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6
SCHEMBL30977284 0.85 HSD11B1 (0.47) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6
SCHEMBL22304414 0.83 AR (0.58) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6
SCHEMBL5541462 0.83 HSD11B1 (0.55) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6
SCHEMBL2492272 0.83 HSD11B1 (0.46) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6
SCHEMBL1262778 0.83 HSD11B1 (0.59) HSD11B1NOTUMALDH1A1CYP3A4CYP2D6

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
WO-2000045435-A1 POLYIMIDES USED AS MICROELECTRONIC COATINGS THE UNIVERSITY OF AKRON (US) 2000-08-03 WO disclosed