SCHEMBL5322943

SCHEMBL5322943

O=C(O)CNc1cccc(Oc2ccc(F)cc2F)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRK2 P25098 2/20 0.60
PTGER2 P43116 1/20 0.50
HIF1A Q16665 1/20 0.46
FFAR1 O14842 3/20 0.43
BRD4 O60885 1/20 0.43
MAPK14 Q16539 1/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 2/20 0.42
BRAF P15056 1/20 0.41
PNLIP P16233 1/20 0.41
HSPB1 P04792 1/20 0.41
KCNQ3 O43525 1/20 0.41
KCNQ2 O43526 1/20 0.41
KCNE1 P15382 1/20 0.41
KCNQ1 P51787 1/20 0.41
MET P08581 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
SCHEMBL5282610 0.81 GRK2 (0.58) GRK2PTGER2HIF1AFFAR1PPARG
SCHEMBL27144496 0.81 HIF1A (0.53) GRK2HIF1APPARGKCNQ3KCNQ2
SCHEMBL5287709 0.80 ALDH1A1 (0.59) GRK2FFAR1
SCHEMBL5413973 0.78 FFAR1 (0.51) GRK2FFAR1
SCHEMBL1430415 0.78 MEN1 (0.58) GRK2PTGER2FFAR1
SCHEMBL27112845 0.76 PPARG (0.59) PPARG
SCHEMBL5537424 0.76 GRK2 (1.00) GRK2
Hydrochloric Acid SCHEMBL20546808 0.75 KMT2A (0.53) GRK2HIF1AFFAR1BRD4PPARG
Hydrochloric Acid SCHEMBL20546809 0.75 KMT2A (0.53) GRK2HIF1AFFAR1BRD4PPARG
SCHEMBL9795747 0.75 NR4A2 (0.63) FFAR1PPARA

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-2007008942-A2 PHENYLAMINO-ACETIC ACID [1-(PYRIDIN-4-YL)-METHYLIDENE]-HYDRAZIDE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF G PROTEIN-COUPLED RECEPTOR KINASES FOR THE TREATMENT OF EYE DISEASES AERIE PHARMACEUTICALS, INC. (US) 2007-01-18 WO disclosed