SCHEMBL5200711

SCHEMBL5200711

O=C(Cl)Cc1ccc(C(F)(F)F)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.50
P2RX7 Q99572 5/20 0.47
DAO P14920 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
KCNQ3 O43525 1/20 0.41
KCNQ2 O43526 1/20 0.41
KCNE1 P15382 1/20 0.41
KCNQ1 P51787 1/20 0.41
FFAR1 O14842 2/20 0.40
KDM1A O60341 1/20 0.39
CSF1R P07333 1/20 0.38
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38

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
SCHEMBL4811433 0.86 NR3C2 (0.46) P2RX7RXRARXRBRXRGKCNQ3
SCHEMBL287631 0.84 RXRA (0.61) KIF11P2RX7DAORXRARXRB
SCHEMBL12672499 0.83 KIF11 (0.51) KIF11P2RX7DAORXRARXRB
Hydrochloric Acid SCHEMBL1373105 0.83 RXRA (0.59) KIF11P2RX7DAORXRARXRB
SCHEMBL27776461 0.83 KIF11 (0.50) KIF11P2RX7DAORXRARXRB
SCHEMBL16237967 0.83 DAO (0.47) P2RX7DAORXRARXRBRXRG
SCHEMBL2173469 0.80 MAPK8 (0.44) DAOKCNQ2
SCHEMBL11434970 0.79 IDO1 (0.54) P2RX7
SCHEMBL2645838 0.79 ALDH1A1 (0.49) KIF11P2RX7DAOFFAR1CSF1R
SCHEMBL1150357 0.77 MAPT (0.44) KCNQ3KCNQ2KCNE1KCNQ1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524715-B2 Phenoxyacetic acid derivatives useful for treating respiratory diseases ASTRAZENECA AB (SE) 2013-09-03 US disclosed
EP-1817282-A1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES AstraZeneca AB (SE) 2007-08-15 EP disclosed
WO-2006056752-A1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2006-06-01 WO disclosed