SCHEMBL8065609

SCHEMBL8065609

COC(=O)c1ccccc1NC(=O)c1ncoc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.64
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
GSK3B P49841 2/20 0.52
ALDH1A1 P00352 6/20 0.50
HSD17B10 Q99714 5/20 0.50
KDM4E B2RXH2 4/20 0.50
MAPT P10636 3/20 0.50
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 3/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAPK1 P28482 2/20 0.46
PPARG P37231 1/20 0.45
NCOA2 Q15596 1/20 0.45
NCOA1 Q15788 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
TP53 P04637 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
SCHEMBL8059444 0.88 GSK3B (0.54) LMNAMEN1KMT2AGSK3BALDH1A1
SCHEMBL8065137 0.87 GSK3B (0.53) LMNAMEN1KMT2AGSK3BALDH1A1
Lithium Ion SCHEMBL8065141 0.86 GSK3B (0.53) LMNAMEN1KMT2AGSK3BALDH1A1
SCHEMBL8065368 0.82 GSK3B (0.58) LMNAMEN1KMT2AGSK3BKDM4E
SCHEMBL8047974 0.78 SMN1; SMN2 (0.51) LMNAMEN1KMT2AALDH1A1HSD17B10
SCHEMBL27541239 0.73 GSK3B (0.66) LMNAGSK3BALDH1A1KDM4EGAA
SCHEMBL472899 0.72 GSK3B (0.55) MEN1KMT2AGSK3BKDM4EMAPT
SCHEMBL1167311 0.71 GSK3B (0.60) MEN1KMT2AGSK3BKDM4EGAA
SCHEMBL6372051 0.70 ADORA2A (0.60) LMNAMEN1KMT2AGSK3BALDH1A1
SCHEMBL8059585 0.70 GSK3B (0.58) GSK3BKDM4EGAA

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-6096770-A ADMINISTERING ORALLY OR PARENTALLY, TO A PATIENT AN ANTHRANILIC ACID DERIVATIVE FOR REDUCING THE ADVERSE EFFECTS OF SMOOTH MUSCLE CONTRACTIONS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-08-01 US disclosed
EP-1003713-A1 ANTHRANILIC ACID ANALOGS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-05-31 EP disclosed
WO-1999007670-A1 ANTHRANILIC ACID ANALOGS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-02-18 WO disclosed