SCHEMBL6001487

SCHEMBL6001487

FC(F)(F)Oc1ccc([CH]c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.44
PIM2 Q9P1W9 1/20 0.44
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
BACE1 P56817 2/20 0.43
KIF11 P52732 2/20 0.42
CYP2D6 P10635 1/20 0.42
GRIN2B Q13224 1/20 0.41
TRPA1 O75762 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
MITF O75030 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
MAPT P10636 2/20 0.40
ACP1 P24666 1/20 0.40
EPHX2 P34913 1/20 0.40
SLC7A5 Q01650 2/20 0.40
CCR6 P51684 1/20 0.40

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
SCHEMBL2092050 0.91 PIM1 (0.49) PIM1PIM2KIF11CYP2D6KMT2A
SCHEMBL2096214 0.82 CCR6 (0.43) PIM1PIM2CYP2D6GRIN2BKMT2A
SCHEMBL168125 0.79 KIF11 (0.47) KIF11GRIN2BKMT2AMEN1RAB9A
SCHEMBL13790221 0.78 CYP2D6 (0.50) PIM1PIM2CYP2D6TRPA1KMT2A
SCHEMBL11408146 0.77 MAPT (0.63) PIM1PIM2BCHEACHEBACE1
SCHEMBL11409628 0.77 G6PD (0.56) BCHEACHEBACE1KIF11KMT2A
SCHEMBL4036809 0.77 KIF11 (0.46) KIF11GRIN2BKMT2AMEN1RAB9A
Fluoride SCHEMBL28371495 0.77 KIF11 (0.46) KIF11GRIN2BKMT2AMEN1RAB9A
Ammonia Solution, Strong SCHEMBL2163079 0.77 KIF11 (0.46) KIF11GRIN2BKMT2AMEN1RAB9A
SCHEMBL29087324 0.77 KIF11 (0.46) KIF11GRIN2BKMT2AMEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed