SCHEMBL8025260

SCHEMBL8025260

FC(F)(F)c1ccc(-c2cccc(-c3ccccc3)c2-c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.65
ALDH1A1 P00352 3/20 0.50
BACE1 P56817 2/20 0.50
TSHR P16473 1/20 0.50
ENPP1 P22413 2/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TOP1 P11387 2/20 0.44
SCN2A Q99250 2/20 0.44
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TRPV6 Q9H1D0 1/20 0.41

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
SCHEMBL11310344 0.87 KIF11 (0.77) KIF11ALDH1A1BACE1TSHRMAPT
SCHEMBL31625453 0.83 KIF11 (0.59) KIF11ALDH1A1BACE1TSHRENPP1
SCHEMBL17840160 0.83 KIF11 (0.68) KIF11ALDH1A1BACE1TSHRTOP1
SCHEMBL5702375 0.82 KIF11 (0.47) KIF11ALDH1A1BACE1TSHRENPP1
SCHEMBL8662997 0.81 PTGES2 (0.51) KIF11BACE1POLB
Bromide SCHEMBL3137328 0.81 KIF11 (0.45) KIF11ALDH1A1BACE1TSHRENPP1
SCHEMBL8025255 0.81 KIF11 (0.65) KIF11ALDH1A1BACE1TSHRTOP1
SCHEMBL3140032 0.80 KIF11 (0.46) KIF11ALDH1A1BACE1ENPP1MAPT
SCHEMBL15069341 0.80 ALDH1A1 (0.50) ALDH1A1BACE1MAPTSMN1; SMN2TDP1
SCHEMBL163728 0.80 KIF11 (1.00) KIF11ALDH1A1BACE1TSHRSCN2A

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